N-{2-[3-({2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-1H-indol-1-yl]ethyl}-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{2-[3-({2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-1H-indol-1-yl]ethyl}-3-(trifluoromethyl)benzamide
N-{2-[3-({2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-1H-indol-1-yl]ethyl}-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | C064-0271 |
| Compound Name: | N-{2-[3-({2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-1H-indol-1-yl]ethyl}-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 519.57 |
| Molecular Formula: | C23 H20 F3 N5 O2 S2 |
| Smiles: | Cc1nnc(NC(CSc2cn(CCNC(c3cccc(c3)C(F)(F)F)=O)c3ccccc23)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.7212 |
| logD: | 3.655 |
| logSw: | -3.9811 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.704 |
| InChI Key: | HLSGHVRMIJEAFX-UHFFFAOYSA-N |