N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C699-0340 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C25 H24 N2 O3 S |
| Smiles: | Cc1ccc(CN2CCSc3ccc(cc23)C(NCc2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7296 |
| logD: | 4.7296 |
| logSw: | -4.4799 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.33 |
| InChI Key: | TZNLKJHILVVNLH-UHFFFAOYSA-N |