N-{3-[2-(morpholin-4-yl)-2-oxoethyl]-1,3-benzothiazol-2(3H)-ylidene}-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{3-[2-(morpholin-4-yl)-2-oxoethyl]-1,3-benzothiazol-2(3H)-ylidene}-3-(trifluoromethyl)benzamide
N-{3-[2-(morpholin-4-yl)-2-oxoethyl]-1,3-benzothiazol-2(3H)-ylidene}-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V007-3619 |
| Compound Name: | N-{3-[2-(morpholin-4-yl)-2-oxoethyl]-1,3-benzothiazol-2(3H)-ylidene}-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 449.45 |
| Molecular Formula: | C21 H18 F3 N3 O3 S |
| Smiles: | C1COCCN1C(CN1/C(=N/C(c2cccc(c2)C(F)(F)F)=O)Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7115 |
| logD: | 2.7115 |
| logSw: | -3.2107 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.56 |
| InChI Key: | FQPWCXARHUZDCF-UHFFFAOYSA-N |