N-[(1-ethylpyrrolidin-2-yl)methyl]-4-[(4-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-[(1-ethylpyrrolidin-2-yl)methyl]-4-[(4-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-[(1-ethylpyrrolidin-2-yl)methyl]-4-[(4-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C699-0650 |
| Compound Name: | N-[(1-ethylpyrrolidin-2-yl)methyl]-4-[(4-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 413.56 |
| Molecular Formula: | C23 H28 F N3 O S |
| Smiles: | CCN1CCCC1CNC(c1ccc2c(c1)N(CCS2)Cc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4175 |
| logD: | 2.8771 |
| logSw: | -3.8734 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.1213 |
| InChI Key: | PONLLOHPKYCQOD-HXUWFJFHSA-N |