1-(2-methyl-1H-indol-3-yl)-2-({5-[(prop-2-en-1-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(2-methyl-1H-indol-3-yl)-2-({5-[(prop-2-en-1-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)ethan-1-one
1-(2-methyl-1H-indol-3-yl)-2-({5-[(prop-2-en-1-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | Y020-1866 |
| Compound Name: | 1-(2-methyl-1H-indol-3-yl)-2-({5-[(prop-2-en-1-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)ethan-1-one |
| Molecular Weight: | 344.46 |
| Molecular Formula: | C16 H16 N4 O S2 |
| Smiles: | Cc1c(C(CSc2nnc(NCC=C)s2)=O)c2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.6548 |
| logD: | 3.6548 |
| logSw: | -4.3401 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.393 |
| InChI Key: | DVRCKJBKRHLQPO-UHFFFAOYSA-N |