Chemical ID: 4140514

c1cc(ccc1NC(=O)NC2CCN3C(C2)C(=O)N(C3=O)c4ccc(cc4)Cl)Cl
Chemical ID:
4140514
Name [?]:
1-(4-chlorophenyl)-3-[8-(4-chlorophenyl)-7,9-dioxo-1,8-diazabicyclo[4.3.0]non-4-yl]-urea
SMILES [?]:
c1cc(ccc1NC(=O)NC2CCN3C(C2)C(=O)N(C3=O)c4ccc(cc4)Cl)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H18Cl2N4O3
All Atoms:29
Heavy Atoms:29
Chiral Atoms:2
ZAP Information [?]
Total:12.4994
Area:629.608
Solvation:-3.24077
Coulombic:-71.011
Bond Count [?]
All:32
Single:23
Double:9
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:433.287
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:3.13
LogP (Chemaxon):3.22

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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