2-{[5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(10H-phenothiazin-10-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(10H-phenothiazin-10-yl)ethan-1-one
2-{[5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(10H-phenothiazin-10-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8018-8774 |
| Compound Name: | 2-{[5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(10H-phenothiazin-10-yl)ethan-1-one |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C23 H18 N4 O2 S2 |
| Smiles: | COc1ccccc1c1nnc([nH]1)SCC(N1c2ccccc2Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9843 |
| logD: | 2.9323 |
| logSw: | -4.1987 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.48 |
| InChI Key: | VOBKIBCQSDHRKQ-UHFFFAOYSA-N |