Chemical ID: 6486722

Cc1cccc(c1)C(=O)Oc2ccc(cc2C=NNC(=O)c3ccc(cc3)Cl)Br
Chemical ID:
6486722
Name [?]:
[4-bromo-2-[(4-chlorobenzoyl)aminoiminomethyl]phenyl] 3-methylbenzoate
SMILES [?]:
Cc1cccc(c1)C(=O)Oc2ccc(cc2C=NNC(=O)c3ccc(cc3)Cl)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H16BrClN2O3
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:12.882
Area:643.587
Solvation:-3.20772
Coulombic:-42.2743
Bond Count [?]
All:31
Single:19
Double:12
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:471.731
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:7.35
LogP (Chemaxon):6.25

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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