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180793-06-0 | 4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbohydrazide
CAS No: 180793-06-0 Catalog No: AG00IXU9 MDL No:MFCD02186601
Product Description
Catalog Number:
AG00IXU9
Chemical Name:
4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbohydrazide
CAS Number:
180793-06-0
Molecular Formula:
C14H14N4OS
Molecular Weight:
286.3522
MDL Number:
MFCD02186601
IUPAC Name:
4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carbohydrazide
InChI:
InChI=1S/C14H14N4OS/c1-8-7-9(2)16-14-10(8)11(18-5-3-4-6-18)12(20-14)13(19)17-15/h3-7H,15H2,1-2H3,(H,17,19)
InChI Key:
KRMDVGPHGBZOLR-UHFFFAOYSA-N
SMILES:
NNC(=O)c1sc2c(c1n1cccc1)c(C)cc(n2)C
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.089g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
286.353g/mol
Monoisotopic Mass:
286.089g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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