Chemical ID: 3865200

Cc1ccc2nc(c(n2c1)NCCC(C)C)c3ccc(cc3)Cl
Chemical ID:
3865200
Name [?]:
8-(4-chlorophenyl)-N-isopentyl-4-methyl-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-amine
SMILES [?]:
Cc1ccc2nc(c(n2c1)NCCC(C)C)c3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H22ClN3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:11.9246
Area:539.335
Solvation:-1.55879
Coulombic:-26.6564
Bond Count [?]
All:25
Single:18
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:327.851
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:5.7
LogP (Chemaxon):5.46

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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