10-ethyl-N-[2-(1H-indol-3-yl)ethyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-ethyl-N-[2-(1H-indol-3-yl)ethyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
10-ethyl-N-[2-(1H-indol-3-yl)ethyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C529-1928 |
| Compound Name: | 10-ethyl-N-[2-(1H-indol-3-yl)ethyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C26 H23 N3 O3 S |
| Smiles: | CCN1C(c2ccccc2S(c2ccc(cc12)C(NCCc1c[nH]c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0878 |
| logD: | 3.0878 |
| logSw: | -3.5808 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.907 |
| InChI Key: | CFIIABZCDPTLRK-UHFFFAOYSA-N |