11-oxo-N-[3-(propylsulfanyl)propyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
11-oxo-N-[3-(propylsulfanyl)propyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
11-oxo-N-[3-(propylsulfanyl)propyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C791-0146 |
| Compound Name: | 11-oxo-N-[3-(propylsulfanyl)propyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 386.53 |
| Molecular Formula: | C20 H22 N2 O2 S2 |
| Smiles: | CCCSCCCNC(c1ccc2c(c1)NC(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9741 |
| logD: | 3.9732 |
| logSw: | -4.0624 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.702 |
| InChI Key: | SYPVZWWPDNIYNZ-UHFFFAOYSA-N |