10-ethyl-11-oxo-N-[(thiophen-2-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-ethyl-11-oxo-N-[(thiophen-2-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-ethyl-11-oxo-N-[(thiophen-2-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K786-2653 |
| Compound Name: | 10-ethyl-11-oxo-N-[(thiophen-2-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 394.51 |
| Molecular Formula: | C21 H18 N2 O2 S2 |
| Smiles: | CCN1C(c2ccccc2Sc2ccc(cc12)C(NCc1cccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5172 |
| logD: | 4.5172 |
| logSw: | -4.2935 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.829 |
| InChI Key: | BGHGZVABHSSBDR-UHFFFAOYSA-N |