Chemical ID: 6136310

COc1ccc(cc1)CN2C(=O)CC(SC2=Nc3cccc(c3)C(F)(F)F)C(=O)Nc4ccccc4
Chemical ID:
6136310
Name [?]:
3-[(4-methoxyphenyl)methyl]-4-oxo-N-phenyl-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide
SMILES [?]:
COc1ccc(cc1)CN2C(=O)CC(SC2=Nc3cccc(c3)C(F)(F)F)C(=O)Nc4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H22F3N3O3S
All Atoms:36
Heavy Atoms:36
Chiral Atoms:1
ZAP Information [?]
Total:11.5868
Area:698.967
Solvation:-5.8874
Coulombic:-68.6957
Bond Count [?]
All:39
Single:27
Double:12
Rotors:8
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:513.533
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.41
LogP (Chemaxon):6.28

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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