11-oxo-N-(2-phenylethyl)-10-(prop-2-en-1-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
11-oxo-N-(2-phenylethyl)-10-(prop-2-en-1-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
11-oxo-N-(2-phenylethyl)-10-(prop-2-en-1-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K784-7766 |
| Compound Name: | 11-oxo-N-(2-phenylethyl)-10-(prop-2-en-1-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 414.53 |
| Molecular Formula: | C25 H22 N2 O2 S |
| Smiles: | C=CCN1C(c2ccccc2Sc2ccc(cc12)C(NCCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6617 |
| logD: | 4.6617 |
| logSw: | -4.7271 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.905 |
| InChI Key: | ZOROPJRGCXQCKN-UHFFFAOYSA-N |