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26180-36-9 | Benzoic acid, 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)-, hydrazide
CAS No: 26180-36-9 Catalog No: AG002S3S MDL No:
Product Description
Catalog Number:
AG002S3S
Chemical Name:
Benzoic acid, 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)-, hydrazide
CAS Number:
26180-36-9
Molecular Formula:
C18H17N3O
Molecular Weight:
291.3471
IUPAC Name:
4-(2-methyl-5-phenylpyrrol-1-yl)benzohydrazide
InChI:
InChI=1S/C18H17N3O/c1-13-7-12-17(14-5-3-2-4-6-14)21(13)16-10-8-15(9-11-16)18(22)20-19/h2-12H,19H2,1H3,(H,20,22)
InChI Key:
QHNBMGZRXKWHIS-UHFFFAOYSA-N
SMILES:
NNC(=O)c1ccc(cc1)n1c(C)ccc1c1ccccc1
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.137g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
291.354g/mol
Monoisotopic Mass:
291.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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