4-[(4-fluorophenyl)methyl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-fluorophenyl)methyl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(4-fluorophenyl)methyl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C699-0745 |
| Compound Name: | 4-[(4-fluorophenyl)methyl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 452.61 |
| Molecular Formula: | C25 H25 F N2 O S2 |
| Smiles: | CSc1ccc(CCNC(c2ccc3c(c2)N(CCS3)Cc2ccc(cc2)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0751 |
| logD: | 5.0751 |
| logSw: | -4.7242 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.056 |
| InChI Key: | MZINCDQKYAPNOQ-UHFFFAOYSA-N |