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ZINC00881398,BAS 02815864,AG-690/15429698,N-[4-(N'-Benzoyl-hydrazi

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摘 要:ZINC00881398,BAS 02815864,AG-690/15429698,N-[4-(N'-Benzoyl-hydrazinocarbonyl)-phenyl]-2-phenyl-acetamide, N-[4-[(benzoylamino)carbamoyl]phenyl]-2-phenylacetamide,Canonical SMILES: C1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3,InChI: In
[Synonyms]
ZINC00881398
BAS 02815864
AG-690/15429698
N-[4-(N'-Benzoyl-hydrazinocarbonyl)-phenyl]-2-phenyl-acetamide

[Structure]
ZINC00881398,BAS 02815864,AG-690/15429698,N-[4-(N'-Benzoyl-hydrazi

[ Properties Computed from Structure]
Molecular Weight373.40456 [g/mol]
Molecular FormulaC22H19N3O3
XLogP3.8
H-Bond Donor3
H-Bond Acceptor3
Rotatable Bond Count5
Tautomer Count10
Exact Mass373.142641
MonoIsotopic Mass373.142641
Topological Polar Surface Area87.3
Heavy Atom Count28
Formal Charge0
Complexity531
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: N-[4-[(benzoylamino)carbamoyl]phenyl]-2-phenylacetamide
Canonical SMILES: C1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3
InChI: InChI=1/C22H19N3O3/c26-20(15-16-7-3-1-4-8-16)23-19-13-11-18(12-14-19)22
(28)25-24-21(27)17-9-5-2-6-10-17/h1-14H,15H2,(H,23,26)(H,24,27)(H,25,
28)/f/h23-25H

 
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