ethyl 1-[(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)carbamoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)carbamoyl]piperidine-4-carboxylate
ethyl 1-[(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)carbamoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | E006-0005 |
| Compound Name: | ethyl 1-[(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)carbamoyl]piperidine-4-carboxylate |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C23 H25 N3 O4 S |
| Smiles: | CCOC(C1CCN(CC1)C(Nc1ccc2c(c1)N(C)C(c1ccccc1S2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6355 |
| logD: | 3.6355 |
| logSw: | -3.876 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.661 |
| InChI Key: | QSCCCWTWVRLCEG-UHFFFAOYSA-N |