4-methyl-N-[3-(morpholin-4-yl)propyl]-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-methyl-N-[3-(morpholin-4-yl)propyl]-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-methyl-N-[3-(morpholin-4-yl)propyl]-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C310-3062 |
| Compound Name: | 4-methyl-N-[3-(morpholin-4-yl)propyl]-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 505.56 |
| Molecular Formula: | C25 H26 F3 N3 O3 S |
| Smiles: | CN1C(/C(=C/c2ccc(cc2)C(F)(F)F)Sc2ccc(cc12)C(NCCCN1CCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4278 |
| logD: | 3.0396 |
| logSw: | -3.9662 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.253 |
| InChI Key: | SXMNGCFYWBGHKB-UHFFFAOYSA-N |