N-{5-[(2-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{5-[(2-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-(trifluoromethyl)benzamide
N-{5-[(2-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | K401-2104 |
| Compound Name: | N-{5-[(2-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 506.57 |
| Molecular Formula: | C16 H13 F3 N6 O2 S4 |
| Smiles: | CCSc1nnc(NC(CSc2nnc(NC(c3cccc(c3)C(F)(F)F)=O)s2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.034 |
| logD: | 4.8946 |
| logSw: | -4.7741 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.019 |
| InChI Key: | VFVHPXFKAPRYMY-UHFFFAOYSA-N |