methyl 2-({4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}amino)-4,5-dimethylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-({4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}amino)-4,5-dimethylthiophene-3-carboxylate
methyl 2-({4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}amino)-4,5-dimethylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | K783-6514 |
| Compound Name: | methyl 2-({4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}amino)-4,5-dimethylthiophene-3-carboxylate |
| Molecular Weight: | 487.04 |
| Molecular Formula: | C24 H23 Cl N2 O3 S2 |
| Smiles: | Cc1c(C(=O)OC)c(NC(c2ccc3c(c2)N(CCS3)Cc2ccc(cc2)[Cl])=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 5.6007 |
| logD: | 3.5629 |
| logSw: | -6.1766 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.861 |
| InChI Key: | HZTSKKJZSSVIHV-UHFFFAOYSA-N |