N-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-2-methyl-2,3-dihydro-4H-1,4-benzothiazine-4-carboxamide
Chemical Structure Depiction of
N-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-2-methyl-2,3-dihydro-4H-1,4-benzothiazine-4-carboxamide
N-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-2-methyl-2,3-dihydro-4H-1,4-benzothiazine-4-carboxamide
Compound characteristics
| Compound ID: | C800-0676 |
| Compound Name: | N-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-2-methyl-2,3-dihydro-4H-1,4-benzothiazine-4-carboxamide |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C25 H23 N3 O4 S |
| Smiles: | CC1CN(C(Nc2ccc(cc2)C(NCc2ccc3c(c2)OCO3)=O)=O)c2ccccc2S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5122 |
| logD: | 4.5122 |
| logSw: | -4.236 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.834 |
| InChI Key: | FGXQJYJDFVUHOQ-INIZCTEOSA-N |