N-(2-{3-[(2-{[5-(ethylsulfanyl)-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-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)sulfanyl]-1H-indol-1-yl}ethyl)-3-(trifluoromethyl)benzamide
N-(2-{3-[(2-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)sulfanyl]-1H-indol-1-yl}ethyl)-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | C064-0270 |
| Compound Name: | N-(2-{3-[(2-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)sulfanyl]-1H-indol-1-yl}ethyl)-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 565.66 |
| Molecular Formula: | C24 H22 F3 N5 O2 S3 |
| Smiles: | CCSc1nnc(NC(CSc2cn(CCNC(c3cccc(c3)C(F)(F)F)=O)c3ccccc23)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.237 |
| logD: | 5.234 |
| logSw: | -5.2181 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.259 |
| InChI Key: | TWDGTTGKJXWMLZ-UHFFFAOYSA-N |