4-[(2-chloro-6-fluorophenyl)methyl]-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(2-chloro-6-fluorophenyl)methyl]-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(2-chloro-6-fluorophenyl)methyl]-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K784-8546 |
| Compound Name: | 4-[(2-chloro-6-fluorophenyl)methyl]-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 552.11 |
| Molecular Formula: | C30 H31 Cl F N3 O2 S |
| Smiles: | Cc1ccc(CN2CCC(CC2)CNC(c2ccc3c(c2)N(Cc2c(cccc2[Cl])F)C(CS3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4912 |
| logD: | 2.7702 |
| logSw: | -5.9015 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.765 |
| InChI Key: | INVJNNFBTVYMMO-UHFFFAOYSA-N |