Chemical ID: 3918493

COCCNc1c(nc2n1cc(cc2)Cl)c3ccccc3
Chemical ID:
3918493
Name [?]:
4-chloro-N-(2-methoxyethyl)-8-phenyl-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-amine
SMILES [?]:
COCCNc1c(nc2n1cc(cc2)Cl)c3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H16ClN3O
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.31209
Area:500.283
Solvation:-3.19499
Coulombic:-33.2324
Bond Count [?]
All:23
Single:16
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:301.771
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.43
LogP (Chemaxon):3.29

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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