Chemical ID: 3918499

CC(C)Nc1c(nc2n1cc(cc2)Cl)c3ccc(cc3)N(C)C
Chemical ID:
3918499
Name [?]:
4-chloro-8-(4-dimethylaminophenyl)-N-isopropyl-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-amine
SMILES [?]:
CC(C)Nc1c(nc2n1cc(cc2)Cl)c3ccc(cc3)N(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H21ClN4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.9614
Area:525.275
Solvation:-2.17045
Coulombic:-31.0828
Bond Count [?]
All:25
Single:18
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:328.839
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.71
LogP (Chemaxon):4.48

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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