N-[3-(morpholin-4-yl)propyl]-8-(trifluoromethyl)-1,2,4,4a,5,6-hexahydro[1,4]thiazino[4,3-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-[3-(morpholin-4-yl)propyl]-8-(trifluoromethyl)-1,2,4,4a,5,6-hexahydro[1,4]thiazino[4,3-a]quinoline-5-carboxamide
N-[3-(morpholin-4-yl)propyl]-8-(trifluoromethyl)-1,2,4,4a,5,6-hexahydro[1,4]thiazino[4,3-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V021-2593 |
| Compound Name: | N-[3-(morpholin-4-yl)propyl]-8-(trifluoromethyl)-1,2,4,4a,5,6-hexahydro[1,4]thiazino[4,3-a]quinoline-5-carboxamide |
| Molecular Weight: | 443.53 |
| Molecular Formula: | C21 H28 F3 N3 O2 S |
| Smiles: | C(CNC(C1Cc2cc(ccc2N2CCSCC12)C(F)(F)F)=O)CN1CCOCC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5197 |
| logD: | 2.0962 |
| logSw: | -2.9317 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.756 |
| InChI Key: | MSFHIFDTGPGSFL-UHFFFAOYSA-N |