ethyl 4-{4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperazine-1-carboxylate
ethyl 4-{4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C699-0497 |
| Compound Name: | ethyl 4-{4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperazine-1-carboxylate |
| Molecular Weight: | 439.58 |
| Molecular Formula: | C24 H29 N3 O3 S |
| Smiles: | CCOC(N1CCN(CC1)C(c1ccc2c(c1)N(CCS2)Cc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6854 |
| logD: | 3.6854 |
| logSw: | -3.8726 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.23 |
| InChI Key: | DOJZMZLEHCTKNI-UHFFFAOYSA-N |