ethyl 1-(5-acetyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(5-acetyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)piperidine-4-carboxylate
ethyl 1-(5-acetyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)piperidine-4-carboxylate
Compound characteristics
| Compound ID: | G269-0058 |
| Compound Name: | ethyl 1-(5-acetyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)piperidine-4-carboxylate |
| Molecular Weight: | 426.55 |
| Molecular Formula: | C19 H26 N2 O5 S2 |
| Smiles: | CCOC(C1CCN(CC1)S(c1ccc2c(c1)N(CCCS2)C(C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.696 |
| logD: | 2.696 |
| logSw: | -3.0246 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 69.086 |
| InChI Key: | OIGXHMJYFVTPAP-UHFFFAOYSA-N |