Chemical ID: 6850425

Cc1cc(ccc1OC(C)C(=O)Oc2ccc(cc2OC)C=C(C#N)C(=O)NCC=C)Cl
Chemical ID:
6850425
Name [?]:
[4-[2-(allylcarbamoyl)-2-cyano-vinyl]-2-methoxy-phenyl] 2-(4-chloro-2-methyl-phenoxy)propanoate
SMILES [?]:
Cc1cc(ccc1OC(C)C(=O)Oc2ccc(cc2OC)C=C(C#N)C(=O)NCC=C)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H23ClN2O5
All Atoms:55
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:12.3315
Area:727.984
Solvation:-5.8681
Coulombic:-61.7787
Bond Count [?]
All:33
Single:22
Double:10
Rotors:11
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:454.903
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:4.61
LogP (Chemaxon):4.39

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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