Chemical ID: 7537995

Cc1cc(c(cc1C)O)c2c3c([nH]n2)C(=O)N(C3c4cccc(c4)Br)CC=C
Chemical ID:
7537995
Name [?]:
3-allyl-2-(3-bromophenyl)-8-(2-hydroxy-4,5-dimethyl-phenyl)-3,6,7-triazabicyclo[3.3.0]octa-7,9-dien-4-one
SMILES [?]:
Cc1cc(c(cc1C)O)c2c3c([nH]n2)C(=O)N(C3c4cccc(c4)Br)CC=C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H20BrN3O2
All Atoms:48
Heavy Atoms:28
Chiral Atoms:None
ZAP Information [?]
Total:10.9478
Area:587.385
Solvation:-3.73684
Coulombic:-46.3178
Bond Count [?]
All:31
Single:21
Double:10
Rotors:4
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:5.27
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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