Also known as: 210826-40-7, Mcc-950, Cp-456773, Crid3, N-((1,2,3,5,6,7-hexahydro-s-indacen-4-yl)carbamoyl)-4-(2-hydroxypropan-2-yl)furan-2-sulfonamide, Unii-6rs86e2bwq

Molecular Formula

C₂₀H₂₄N₂O₅S

Molecular Weight

404.5 g/mol

InChI Key

HUUSXLKCTQDPGL-UHFFFAOYSA-N

FDA UNII

6RS86E2BWQ

1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea

2.1.2 InChI

InChI=1S/C20H24N2O5S/c1-20(2,24)14-10-17(27-11-14)28(25,26)22-19(23)21-18-15-7-3-5-12(15)9-13-6-4-8-16(13)18/h9-11,24H,3-8H2,1-2H3,(H2,21,22,23)

2.1.3 InChI Key

HUUSXLKCTQDPGL-UHFFFAOYSA-N

2.2 Other Identifiers

2.2.1 UNII

6RS86E2BWQ

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 2-furansulfonamide, N-(((1,2,3,5,6,7-hexahydro-s-indacen-4-yl)amino)carbonyl)-4-(1-hydroxy-1-methylethyl)-

2. Cp-456,773

3. Cp-456773

4. Crid3

5. Mcc-950

6. N-(1,2,3,5,6,7-hexahydro-s-indacen-4-ylcarbamoyl)-4-(2-hydroxy-2-propanyl)-2-furansulfonamide

2.3.2 Depositor-Supplied Synonyms

1. 210826-40-7

2. Mcc-950

3. Cp-456773

4. Crid3

5. N-((1,2,3,5,6,7-hexahydro-s-indacen-4-yl)carbamoyl)-4-(2-hydroxypropan-2-yl)furan-2-sulfonamide

6. Unii-6rs86e2bwq

7. Cp-456,773

8. 6rs86e2bwq

9. Dtxsid2047301

10. 1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea

11. Chembl3183703

12. Dtxcid0027301

13. N-(1,2,3,5,6,7-hexahydro-s-indacen-4-ylcarbamoyl)-4-(2-hydroxypropan-2-yl)furan-2-sulfonamide

14. N-[[(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)amino]carbonyl]-4-(1-hydroxy-1-methylethyl)-2-furansulfonamide

15. 1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[4-(2-oxidanylpropan-2-yl)furan-2-yl]sulfonyl-urea

16. Mfcd30478884

17. 1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-(2-hydroxypropan-2-yl)furan-2-yl)sulfonylurea

18. 7yn

19. Mfcd28900720

20. Gtpl8228

21. Schembl6521858

22. Chebi:231684

23. Glxc-10741

24. Bcp15729

25. Ex-a1052

26. Tox21_300462

27. Bdbm50155926

28. S8930

29. Akos030238802

30. As-5972

31. Sb19010

32. Ncgc00248064-01

33. Ncgc00254269-01

34. 2-furansulfonamide, N-(((1,2,3,5,6,7-hexahydro-s-indacen-4-yl)amino)carbonyl)-4-(1-hydroxy-1-methylethyl)-

35. Ac-35299

36. Da-75353

37. Hy-12815

38. N-(1,2,3,5,6,7-hexahydro-s-indacen-4-ylcarbamoyl)-4-(2-hydroxy-2-propanyl)-2-furansulfonamide

39. Sy242180

40. Cas-210826-40-7

41. En300-24107374

42. Brd-k55418700-001-02-2

43. Q27083691

44. 1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-ylsulfonyl]urea

45. 1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-{[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonyl}urea

46. 8gi

2.4 Create Date

2006-10-25

3 Chemical and Physical Properties

Molecular Formula	C₂₀H₂₄N₂O₅S
Molecular Weight	404.5 g/mol
XLogP3	3.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	117
Heavy Atom Count	28
Formal Charge	0
Complexity	684
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

Mcc950

Mcc950

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