N-(2-methylphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)piperidine-4-carboxamide
N-(2-methylphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E959-1546 |
| Compound Name: | N-(2-methylphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C21 H23 N3 O4 S2 |
| Smiles: | Cc1ccccc1NC(C1CCN(CC1)S(c1ccc2c(c1)NC(CS2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1525 |
| logD: | 2.1525 |
| logSw: | -2.7118 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.164 |
| InChI Key: | AKSVXQPUGHDTKH-UHFFFAOYSA-N |