N-(2-{3-[(2-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)sulfanyl]-1H-indol-1-yl}ethyl)thiophene-2-carboxamide
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)thiophene-2-carboxamide
N-(2-{3-[(2-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)sulfanyl]-1H-indol-1-yl}ethyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | C064-0441 |
| Compound Name: | N-(2-{3-[(2-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)sulfanyl]-1H-indol-1-yl}ethyl)thiophene-2-carboxamide |
| Molecular Weight: | 503.68 |
| Molecular Formula: | C21 H21 N5 O2 S4 |
| Smiles: | CCSc1nnc(NC(CSc2cn(CCNC(c3cccs3)=O)c3ccccc23)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.2685 |
| logD: | 4.2655 |
| logSw: | -3.9229 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.277 |
| InChI Key: | YEXXTACPTDSXEY-UHFFFAOYSA-N |