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478079-40-2 | 4-methyl-N'-{thieno[2,3-b]quinoline-2-carbonyl}benzohydrazide
CAS No: 478079-40-2 Catalog No: AG00IYTO MDL No:MFCD02571600
Product Description
Catalog Number:
AG00IYTO
Chemical Name:
4-methyl-N'-{thieno[2,3-b]quinoline-2-carbonyl}benzohydrazide
CAS Number:
478079-40-2
Molecular Formula:
C20H15N3O2S
Molecular Weight:
361.4170
MDL Number:
MFCD02571600
IUPAC Name:
N'-(4-methylbenzoyl)thieno[2,3-b]quinoline-2-carbohydrazide
InChI:
InChI=1S/C20H15N3O2S/c1-12-6-8-13(9-7-12)18(24)22-23-19(25)17-11-15-10-14-4-2-3-5-16(14)21-20(15)26-17/h2-11H,1H3,(H,22,24)(H,23,25)
InChI Key:
KZMWUDMIZXUWCJ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)NNC(=O)c1cc2c(s1)nc1c(c2)cccc1
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.088g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
361.419g/mol
Monoisotopic Mass:
361.088g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
99.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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