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478079-53-7 | 3-methyl-N'-{thieno[2,3-b]quinoline-2-carbonyl}benzohydrazide
CAS No: 478079-53-7 Catalog No: AG00IQPG MDL No:MFCD02571605
Product Description
Catalog Number:
AG00IQPG
Chemical Name:
3-methyl-N'-{thieno[2,3-b]quinoline-2-carbonyl}benzohydrazide
CAS Number:
478079-53-7
Molecular Formula:
C20H15N3O2S
Molecular Weight:
361.4170
MDL Number:
MFCD02571605
IUPAC Name:
N'-(3-methylbenzoyl)thieno[2,3-b]quinoline-2-carbohydrazide
InChI:
InChI=1S/C20H15N3O2S/c1-12-5-4-7-14(9-12)18(24)22-23-19(25)17-11-15-10-13-6-2-3-8-16(13)21-20(15)26-17/h2-11H,1H3,(H,22,24)(H,23,25)
InChI Key:
RVCBOYLOEQZXCL-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)C(=O)NNC(=O)c1cc2c(s1)nc1c(c2)cccc1
Properties
Complexity:
543
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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