11-ethyl-2-methyl-N-[3-(propylsulfanyl)propyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
11-ethyl-2-methyl-N-[3-(propylsulfanyl)propyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide
11-ethyl-2-methyl-N-[3-(propylsulfanyl)propyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-3745 |
| Compound Name: | 11-ethyl-2-methyl-N-[3-(propylsulfanyl)propyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 412.62 |
| Molecular Formula: | C23 H28 N2 O S2 |
| Smiles: | CCCSCCCNC(c1ccc2c(c1)N=C(CC)c1cc(C)ccc1S2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4798 |
| logD: | 5.4794 |
| logSw: | -5.2706 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.757 |
| InChI Key: | NZTPRPFNMZHGER-UHFFFAOYSA-N |