Chemical ID: 4556073

COc1ccc(cc1)C=CC(=O)CC(c2ccccc2)Nc3ccc(cc3)C(=O)OC
Chemical ID:
4556073
Name [?]:
methyl 4-[5-(4-methoxyphenyl)-3-oxo-1-phenyl-pent-4-enyl]aminobenzoate
SMILES [?]:
COc1ccc(cc1)C=CC(=O)CC(c2ccccc2)Nc3ccc(cc3)C(=O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H25NO4
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:11.1527
Area:665.854
Solvation:-5.49366
Coulombic:-48.0354
Bond Count [?]
All:33
Single:21
Double:12
Rotors:10
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:415.481
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.51
LogP (Chemaxon):5.35

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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