2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine
Chemical Structure Depiction of
2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine
2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine
Compound characteristics
Compound ID: | D441-0036 |
Compound Name: | 2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine |
Molecular Weight: | 480.63 |
Molecular Formula: | C24 H32 N8 O S |
Smiles: | Cc1ccccc1OCCSc1ncn(c2nc(nc(n2)N2CCCCC2)N2CCCCC2)n1 |
Stereo: | ACHIRAL |
logP: | 6.5995 |
logD: | 6.5994 |
logSw: | -5.8685 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 63.685 |
InChI Key: | IBLMSUBQVKOCPX-UHFFFAOYSA-N |