N-[2-(1H-indol-3-yl)ethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[2-(1H-indol-3-yl)ethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C791-0093 |
| Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 413.5 |
| Molecular Formula: | C24 H19 N3 O2 S |
| Smiles: | C(CNC(c1ccc2c(c1)NC(c1ccccc1S2)=O)=O)c1c[nH]c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.3507 |
| logD: | 4.3498 |
| logSw: | -4.3609 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 59.301 |
| InChI Key: | KXEHJDJLWXXJIT-UHFFFAOYSA-N |