Chemical ID: 4149740

COc1ccc(cc1OC)C=CC(=O)Oc2ccc(cc2OC)C=C(C#N)c3ccc(cc3)Cl
Chemical ID:
4149740
Name [?]:
[4-[2-(4-chlorophenyl)-2-cyano-vinyl]-2-methoxy-phenyl] 3-(3,4-dimethoxyphenyl)prop-2-enoate
SMILES [?]:
COc1ccc(cc1OC)C=CC(=O)Oc2ccc(cc2OC)C=C(C#N)c3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H22ClNO5
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:10.4416
Area:728.709
Solvation:-7.77613
Coulombic:-46.3944
Bond Count [?]
All:36
Single:23
Double:12
Rotors:9
Chiral:2
Rigid Segments:9
Chemical Properties
Molecular Weight:475.92
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:5.48
LogP (Chemaxon):5.57

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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