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1609394-10-6

DRL offers a portfolio of products & services, including APIs, CMO services, generics, biosimilars & differentiated formulations.

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Valsynthese, part of the SSE Group, is a CDMO focused on highly energetic and highly hazardous chemistry.

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xyz-pharma-m-2024-10-07

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With Fermion, start the journey of your innovative API.

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Bloomage is a one-stop source for CEP Sodium Hyaluronate and Hyaluronic Acid// FDA-inspected & GMP-certified.

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xyz-pharma-m-2024-10-07

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CHEMISTRY

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Chemistry

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Also known as: 1609394-10-6, 2-methoxy-3-(1-methyl-1,2,4-triazol-3-yl)aniline, Mfcd30489435, Benzenamine, 2-methoxy-3-(1-methyl-1h-1,2,4-triazol-3-yl)-, Schembl15690539, Tqr1149

Molecular Formula

C₁₀H₁₂N₄O

Molecular Weight

204.23 g/mol

InChI Key

FIAZRZSVFOMYSD-UHFFFAOYSA-N

1609394-10-6

1 2D Structure

1609394-10-6

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-methoxy-3-(1-methyl-1,2,4-triazol-3-yl)aniline

2.1.2 InChI

InChI=1S/C10H12N4O/c1-14-6-12-10(13-14)7-4-3-5-8(11)9(7)15-2/h3-6H,11H2,1-2H3

2.1.3 InChI Key

FIAZRZSVFOMYSD-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN1C=NC(=N1)C2=C(C(=CC=C2)N)OC

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1609394-10-6

2. 2-methoxy-3-(1-methyl-1,2,4-triazol-3-yl)aniline

3. Mfcd30489435

4. Benzenamine, 2-methoxy-3-(1-methyl-1h-1,2,4-triazol-3-yl)-

5. Schembl15690539

6. Tqr1149

7. Zinc150057141

8. At10631

9. As-80499

10. Sy253865

11. Cs-0120604

12. En300-1697551

13. A901284

14. A1-44851

2.3 Create Date

2015-02-13

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₂N₄O
Molecular Weight	204.23 g/mol
XLogP3	1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	66
Heavy Atom Count	15
Formal Charge	0
Complexity	214
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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