Chemical ID: 5927275

CCOC(=O)CNc1c(nc2n1cc(cc2)Cl)c3ccccc3Cl
Chemical ID:
5927275
Name [?]:
ethyl 2-[[4-chloro-8-(2-chlorophenyl)-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-yl]amino]acetate
SMILES [?]:
CCOC(=O)CNc1c(nc2n1cc(cc2)Cl)c3ccccc3Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H15Cl2N3O2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.9964
Area:555.137
Solvation:-2.88204
Coulombic:-43.9612
Bond Count [?]
All:26
Single:18
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:364.225
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.37
LogP (Chemaxon):3.89

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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