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CAS 1038924-61-6 manufacturers and suppliers on PharmaCompass

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CAS 1038924-61-6
Also known as: 1038924-61-6, (s)-5-([1,1'-biphenyl]-4-ylmethyl)pyrrolidin-2-one, (s)-5-((biphenyl-4-yl)methyl)pyrrolidin-2-one, Schembl597775, Bcp12555, Mfcd26401537
Molecular Formula
C17H17NO
Molecular Weight
251.32  g/mol
InChI Key
SOBIWLIICMUXJK-INIZCTEOSA-N

1 2D Structure

CAS 1038924-61-6

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(5S)-5-[(4-phenylphenyl)methyl]pyrrolidin-2-one
2.1.2 InChI
InChI=1S/C17H17NO/c19-17-11-10-16(18-17)12-13-6-8-15(9-7-13)14-4-2-1-3-5-14/h1-9,16H,10-12H2,(H,18,19)/t16-/m0/s1
2.1.3 InChI Key
SOBIWLIICMUXJK-INIZCTEOSA-N
2.1.4 Canonical SMILES
C1CC(=O)NC1CC2=CC=C(C=C2)C3=CC=CC=C3
2.1.5 Isomeric SMILES
C1CC(=O)N[C@@H]1CC2=CC=C(C=C2)C3=CC=CC=C3
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 1038924-61-6

2. (s)-5-([1,1'-biphenyl]-4-ylmethyl)pyrrolidin-2-one

3. (s)-5-((biphenyl-4-yl)methyl)pyrrolidin-2-one

4. Schembl597775

5. Bcp12555

6. Mfcd26401537

7. Zinc114182819

8. Ac-30894

9. (s)-5-biphenyl-4-ylmethylpyrrolidin-2-one

10. A854794

2.3 Create Date
2012-08-19
3 Chemical and Physical Properties
Molecular Weight 251.32 g/mol
Molecular Formula C17H17NO
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass251.131014166 g/mol
Monoisotopic Mass251.131014166 g/mol
Topological Polar Surface Area29.1 Ų
Heavy Atom Count19
Formal Charge0
Complexity300
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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Jiangsu Yutian Pharmaceutical Co., Ltd. is located in Dapu Pharmaceutical Zone of Lianyungang City in Jia...
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Jiangsu Yutian Pharmaceutical Co., Ltd. is located in Dapu Pharmaceutical Zone of Lianyungang City in Jia...
Jiangsu Yutian Pharmaceutical Co., Ltd. is located in Dapu Pharmaceutical Zone of Lianyungang City in Jiangsu Province. It is a new and high-tech enterprise engaged in research and production of bulk pharmaceutical chemicals, medical high-grade intermediate and other fine chemicals. We make efforts to provide wide customers with superior quality product. Covering an area of 66400 square meters and a construction area of 37600 square meters, our company has 8 synthesis plants, 1 GMP and FDA standard cleaning shop, modern and advanced production equipment, leading grade laboratory and excellent quality control center. In addition, there is outstanding technology development, production and management talents. Due to high quality and superior service, our products have been exported to Japan, South Korea, India and Europe. We sincerely welcome wide customers to visit us and pay guidance on our work! We would like to create brilliant future hand in hand with you!
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Sacubitril Sodium
Jiangsu Yutian Pharmaceutical Co., Ltd. is located in Dapu Pharmaceutical Zone of Lianyungang City in Jia...
Jiangsu Yutian Pharmaceutical Co., Ltd. is located in Dapu Pharmaceutical Zone of Lianyungang City in Jiangsu Province. It is a new and high-tech enterprise engaged in research and production of bulk pharmaceutical chemicals, medical high-grade intermediate and other fine chemicals. We make efforts to provide wide customers with superior quality product. Covering an area of 66400 square meters and a construction area of 37600 square meters, our company has 8 synthesis plants, 1 GMP and FDA standard cleaning shop, modern and advanced production equipment, leading grade laboratory and excellent quality control center. In addition, there is outstanding technology development, production and management talents. Due to high quality and superior service, our products have been exported to Japan, South Korea, India and Europe. We sincerely welcome wide customers to visit us and pay guidance on our work! We would like to create brilliant future hand in hand with you!
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