4-({[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
4-({[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-3,4-dihydroquinoxalin-2(1H)-one
4-({[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | 8017-3947 |
| Compound Name: | 4-({[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 409.47 |
| Molecular Formula: | C20 H19 N5 O3 S |
| Smiles: | Cn1c(c2ccc(cc2)OC)nnc1SCC(N1CC(Nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3046 |
| logD: | 2.3032 |
| logSw: | -2.7123 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.485 |
| InChI Key: | RTZYIYXSXYRRKY-UHFFFAOYSA-N |