Chemical ID: 4853036

CCCCN1C(=O)CC(SC1=Nc2cccc(c2)C(F)(F)F)C(=O)Nc3ccc(cc3)F
Chemical ID:
4853036
Name [?]:
3-butyl-N-(4-fluorophenyl)-4-oxo-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide
SMILES [?]:
CCCCN1C(=O)CC(SC1=Nc2cccc(c2)C(F)(F)F)C(=O)Nc3ccc(cc3)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H21F4N3O2S
All Atoms:32
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:10.9616
Area:640.505
Solvation:-5.05102
Coulombic:-64.2738
Bond Count [?]
All:34
Single:25
Double:9
Rotors:8
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:467.481
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.3
LogP (Chemaxon):6.1

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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