Chemical ID: 6647043

CCC(C(=O)NN=Cc1ccc(cc1)OC(=O)c2ccccc2C)Oc3ccc(cc3Cl)Cl
Chemical ID:
6647043
Name [?]:
[4-[2-(2,4-dichlorophenoxy)butanoylaminoiminomethyl]phenyl] 2-methylbenzoate
SMILES [?]:
CCC(C(=O)NN=Cc1ccc(cc1)OC(=O)c2ccccc2C)Oc3ccc(cc3Cl)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H22Cl2N2O4
All Atoms:33
Heavy Atoms:33
Chiral Atoms:1
ZAP Information [?]
Total:12.7079
Area:729.286
Solvation:-5.52423
Coulombic:-48.73
Bond Count [?]
All:35
Single:23
Double:12
Rotors:10
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:485.359
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:7.74
LogP (Chemaxon):6.76

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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