2-bromo-11-ethyl-N-[2-(morpholin-4-yl)ethyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
2-bromo-11-ethyl-N-[2-(morpholin-4-yl)ethyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide
2-bromo-11-ethyl-N-[2-(morpholin-4-yl)ethyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-2180 |
| Compound Name: | 2-bromo-11-ethyl-N-[2-(morpholin-4-yl)ethyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 474.42 |
| Molecular Formula: | C22 H24 Br N3 O2 S |
| Smiles: | CCC1c2cc(ccc2Sc2ccc(cc2N=1)C(NCCN1CCOCC1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.1148 |
| logD: | 4.1007 |
| logSw: | -4.1225 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.376 |
| InChI Key: | SGCFOYZVUVLONK-UHFFFAOYSA-N |