N-[(2,3-dimethoxyphenyl)methyl]-4-[(4-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-[(2,3-dimethoxyphenyl)methyl]-4-[(4-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-[(2,3-dimethoxyphenyl)methyl]-4-[(4-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C796-0299 |
| Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-4-[(4-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C25 H25 F N2 O3 S |
| Smiles: | COc1cccc(CNC(c2ccc3c(c2)N(CCS3)Cc2ccc(cc2)F)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 4.5632 |
| logD: | 4.5632 |
| logSw: | -4.3636 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.562 |
| InChI Key: | IQLCJOXCSMNVLR-UHFFFAOYSA-N |