N-[2-(cyclohex-1-en-1-yl)ethyl]-2-methyl-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-methyl-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-methyl-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-1344 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-methyl-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 418.6 |
| Molecular Formula: | C26 H30 N2 O S |
| Smiles: | CCCC1c2cc(C)ccc2Sc2ccc(cc2N=1)C(NCCC1CCCCC=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4294 |
| logD: | 6.4291 |
| logSw: | -5.5189 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.678 |
| InChI Key: | LYRRTXXJTWCKMA-UHFFFAOYSA-N |