3-{4-(3-methoxyphenyl)-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1H-indole
Chemical Structure Depiction of
3-{4-(3-methoxyphenyl)-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1H-indole
3-{4-(3-methoxyphenyl)-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1H-indole
Compound characteristics
| Compound ID: | G878-0041 |
| Compound Name: | 3-{4-(3-methoxyphenyl)-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1H-indole |
| Molecular Weight: | 362.45 |
| Molecular Formula: | C20 H18 N4 O S |
| Smiles: | COc1cccc(c1)n1c(c2c[nH]c3ccccc23)nnc1SCC=C |
| Stereo: | ACHIRAL |
| logP: | 4.8285 |
| logD: | 4.8285 |
| logSw: | -4.8243 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.399 |
| InChI Key: | HPQOQWRCJKLVJO-UHFFFAOYSA-N |