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Home > Indoles and Oxindole > 477860-44-9
477860-44-9 | 8-methyl-N'-(4-methylbenzenesulfonyl)-8H-thieno[2,3-b]indole-2-carbohydrazide
CAS No: 477860-44-9 Catalog No: AG00IO49 MDL No:MFCD01814687
Product Description
Catalog Number:
AG00IO49
Chemical Name:
8-methyl-N'-(4-methylbenzenesulfonyl)-8H-thieno[2,3-b]indole-2-carbohydrazide
CAS Number:
477860-44-9
Molecular Formula:
C19H17N3O3S2
Molecular Weight:
399.4866
MDL Number:
MFCD01814687
IUPAC Name:
4-methyl-N'-(4-methylphenyl)sulfonylthieno[2,3-b]indole-2-carbohydrazide
InChI:
InChI=1S/C19H17N3O3S2/c1-12-7-9-13(10-8-12)27(24,25)21-20-18(23)17-11-15-14-5-3-4-6-16(14)22(2)19(15)26-17/h3-11,21H,1-2H3,(H,20,23)
InChI Key:
XWBUTOIVPANVTN-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)NNC(=O)c1cc2c(s1)n(c1c2cccc1)C
Properties
Complexity:
658
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.071g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
399.483g/mol
Monoisotopic Mass:
399.071g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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