Chemical ID: 5927808

c1cc(ccc1c2c(n3cc(ccc3n2)Br)NC4CCCCC4)Cl
Chemical ID:
5927808
Name [?]:
3-bromo-8-(4-chlorophenyl)-N-cyclohexyl-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-amine
SMILES [?]:
c1cc(ccc1c2c(n3cc(ccc3n2)Br)NC4CCCCC4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H19BrClN3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:12.2218
Area:543.499
Solvation:-1.3657
Coulombic:-26.7545
Bond Count [?]
All:27
Single:20
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:404.731
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:6.25
LogP (Chemaxon):5.84

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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