N-butyl-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-butyl-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-butyl-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-0281 |
| Compound Name: | N-butyl-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 338.47 |
| Molecular Formula: | C20 H22 N2 O S |
| Smiles: | CCCCNC(c1ccc2c(c1)N=C(CC)c1ccccc1S2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7997 |
| logD: | 4.7994 |
| logSw: | -4.4569 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.757 |
| InChI Key: | DWJJOPMDTHBMAX-UHFFFAOYSA-N |