Chemical ID: 6646905

Cc1ccc(cc1)C(=O)Oc2ccc(cc2C=NNC(=O)COc3cc(ccc3C)C(C)C)Br
Chemical ID:
6646905
Name [?]:
[4-bromo-2-[[2-(5-isopropyl-2-methyl-phenoxy)acetyl]aminoiminomethyl]phenyl] 4-methylbenzoate
SMILES [?]:
Cc1ccc(cc1)C(=O)Oc2ccc(cc2C=NNC(=O)COc3cc(ccc3C)C(C)C)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H27BrN2O4
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:13.1783
Area:748.291
Solvation:-5.52895
Coulombic:-47.9916
Bond Count [?]
All:36
Single:24
Double:12
Rotors:10
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:523.418
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:8.04
LogP (Chemaxon):7.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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