Chemical ID: 5534079

CN1C(=O)CC(SC1=Nc2ccc(cc2)I)C(=O)Nc3ccccc3Cl
Chemical ID:
5534079
Name [?]:
N-(2-chlorophenyl)-2-(4-iodophenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
SMILES [?]:
CN1C(=O)CC(SC1=Nc2ccc(cc2)I)C(=O)Nc3ccccc3Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H15ClIN3O2S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:1
ZAP Information [?]
Total:11.9974
Area:603.314
Solvation:-3.08548
Coulombic:-43.2121
Bond Count [?]
All:28
Single:19
Double:9
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:499.754
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.55
LogP (Chemaxon):4.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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