4-[(2,5-dimethylphenyl)methyl]-3-oxo-N-[(thiophen-2-yl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(2,5-dimethylphenyl)methyl]-3-oxo-N-[(thiophen-2-yl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(2,5-dimethylphenyl)methyl]-3-oxo-N-[(thiophen-2-yl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C122-0432 |
| Compound Name: | 4-[(2,5-dimethylphenyl)methyl]-3-oxo-N-[(thiophen-2-yl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 422.57 |
| Molecular Formula: | C23 H22 N2 O2 S2 |
| Smiles: | Cc1ccc(C)c(CN2C(CSc3ccc(cc23)C(NCc2cccs2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.9906 |
| logD: | 4.9906 |
| logSw: | -4.5464 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.051 |
| InChI Key: | DAFIJILZPXAHTB-UHFFFAOYSA-N |