11-ethyl-2-methyl-N-(2-phenylethyl)dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
11-ethyl-2-methyl-N-(2-phenylethyl)dibenzo[b,f][1,4]thiazepine-8-carboxamide
11-ethyl-2-methyl-N-(2-phenylethyl)dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-1229 |
| Compound Name: | 11-ethyl-2-methyl-N-(2-phenylethyl)dibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C25 H24 N2 O S |
| Smiles: | CCC1c2cc(C)ccc2Sc2ccc(cc2N=1)C(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5052 |
| logD: | 5.5048 |
| logSw: | -5.3258 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.486 |
| InChI Key: | JWCHWCCAADLFQG-UHFFFAOYSA-N |