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477855-85-9 | 4-methyl-N'-{8-methyl-8H-thieno[2,3-b]indole-2-carbonyl}benzohydrazide
CAS No: 477855-85-9 Catalog No: AG00INO1 MDL No:MFCD01814663
Product Description
Catalog Number:
AG00INO1
Chemical Name:
4-methyl-N'-{8-methyl-8H-thieno[2,3-b]indole-2-carbonyl}benzohydrazide
CAS Number:
477855-85-9
Molecular Formula:
C20H17N3O2S
Molecular Weight:
363.4329
MDL Number:
MFCD01814663
IUPAC Name:
4-methyl-N'-(4-methylbenzoyl)thieno[2,3-b]indole-2-carbohydrazide
InChI:
InChI=1S/C20H17N3O2S/c1-12-7-9-13(10-8-12)18(24)21-22-19(25)17-11-15-14-5-3-4-6-16(14)23(2)20(15)26-17/h3-11H,1-2H3,(H,21,24)(H,22,25)
InChI Key:
IQNJJKQVUBITSI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)NNC(=O)c1cc2c(s1)n(c1c2cccc1)C
Properties
Complexity:
549
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.104g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
363.435g/mol
Monoisotopic Mass:
363.104g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
91.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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