Chemical ID: 6883179

Cc1c2c(ncn(c2=O)CC(=O)Nc3cc(ccc3Cl)Cl)sc1C(=O)OCC(C)C
Chemical ID:
6883179
Name [?]:
isobutyl 3-[(2,5-dichlorophenyl)carbamoylmethyl]-9-methyl-2-oxo-7-thia-3,5-diazabicyclo[4.3.0]nona-4,8,10-triene-8-carboxylate
SMILES [?]:
Cc1c2c(ncn(c2=O)CC(=O)Nc3cc(ccc3Cl)Cl)sc1C(=O)OCC(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H19Cl2N3O4S
All Atoms:49
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:13.2097
Area:686.2
Solvation:-3.94527
Coulombic:-62.9409
Bond Count [?]
All:32
Single:23
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:468.354
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.92
LogP (Chemaxon):3.41

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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