2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)-4,6-bis(morpholin-4-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-bis(morpholin-4-yl)-1,3,5-triazine
2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)-4,6-bis(morpholin-4-yl)-1,3,5-triazine
Compound characteristics
| Compound ID: | D441-0030 |
| Compound Name: | 2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)-4,6-bis(morpholin-4-yl)-1,3,5-triazine |
| Molecular Weight: | 484.58 |
| Molecular Formula: | C22 H28 N8 O3 S |
| Smiles: | Cc1ccccc1OCCSc1ncn(c2nc(nc(n2)N2CCOCC2)N2CCOCC2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2822 |
| logD: | 4.2821 |
| logSw: | -4.3671 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.502 |
| InChI Key: | WHYNMFJBAOLJMQ-UHFFFAOYSA-N |