Chemical ID: 4848155

CCOC(=O)c1ccc(cc1)NC(=O)C2CC(=O)N(C(=Nc3cccc(c3)Cl)S2)C
Chemical ID:
4848155
Name [?]:
ethyl 4-[[2-(3-chlorophenyl)imino-3-methyl-4-oxo-1,3-thiazinan-6-yl]carbonylamino]benzoate
SMILES [?]:
CCOC(=O)c1ccc(cc1)NC(=O)C2CC(=O)N(C(=Nc3cccc(c3)Cl)S2)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H20ClN3O4S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:12.5238
Area:669.431
Solvation:-4.21193
Coulombic:-61.8898
Bond Count [?]
All:32
Single:22
Double:10
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:445.92
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:2.84
LogP (Chemaxon):4.28

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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