Chemical ID: 6621533

c1ccc(c(c1)C(=O)Oc2ccc(cc2)C=NNC(=O)C(=O)Nc3ccc(cc3)Br)Cl
Chemical ID:
6621533
Name [?]:
[4-[[(4-bromophenyl)carbamoylformyl]aminoiminomethyl]phenyl] 2-chlorobenzoate
SMILES [?]:
c1ccc(c(c1)C(=O)Oc2ccc(cc2)C=NNC(=O)C(=O)Nc3ccc(cc3)Br)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H15BrClN3O4
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:13.2469
Area:681.567
Solvation:-3.79223
Coulombic:-65.3568
Bond Count [?]
All:33
Single:20
Double:13
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:500.729
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:5.95
LogP (Chemaxon):5.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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