Chemical ID: 4554562

CC(=C(C(=O)NC(Cc1ccccc1)C(=O)O)NC(=O)c2ccccc2)C
Chemical ID:
4554562
Name [?]:
2-(2-benzamido-3-methyl-but-2-enoyl)amino-3-phenyl-propanoic acid
SMILES [?]:
CC(=C(C(=O)NC(Cc1ccccc1)C(=O)O)NC(=O)c2ccccc2)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H22N2O4
All Atoms:27
Heavy Atoms:27
Chiral Atoms:1
ZAP Information [?]
Total:10.2226
Area:577.575
Solvation:-4.21679
Coulombic:-72.7201
Bond Count [?]
All:28
Single:18
Double:10
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:366.41
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:2.81
LogP (Chemaxon):2.75

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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