Chemical ID: 6153268

CCN1C(=O)CC(SC1=Nc2ccc(c(c2)C)C)C(=O)Nc3ccc(cc3)C(=O)OCC
Chemical ID:
6153268
Name [?]:
ethyl 4-[[2-(3,4-dimethylphenyl)imino-3-ethyl-4-oxo-1,3-thiazinan-6-yl]carbonylamino]benzoate
SMILES [?]:
CCN1C(=O)CC(SC1=Nc2ccc(c(c2)C)C)C(=O)Nc3ccc(cc3)C(=O)OCC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H27N3O4S
All Atoms:32
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:13.2648
Area:698.597
Solvation:-4.2001
Coulombic:-61.7742
Bond Count [?]
All:34
Single:24
Double:10
Rotors:8
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:453.555
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.51
LogP (Chemaxon):5.04

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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