4-({3-benzyl-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid
Chemical Structure Depiction of
4-({3-benzyl-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid
4-({3-benzyl-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid
Compound characteristics
| Compound ID: | 4514-0423 |
| Compound Name: | 4-({3-benzyl-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid |
| Molecular Weight: | 477.51 |
| Molecular Formula: | C25 H20 F N3 O4 S |
| Smiles: | C1C(C(Nc2ccc(cc2)C(O)=O)=O)SC(=N/c2ccc(cc2)F)\N(Cc2ccccc2)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5956 |
| logD: | 2.2004 |
| logSw: | -4.4164 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.547 |
| InChI Key: | VJJMTOMWCLOTER-NRFANRHFSA-N |