6-{[4-acetyl-5-(4-ethoxy-3-methoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methyl}-1,2,4-triazine-3,5(2H,4H)-dione
Chemical Structure Depiction of
6-{[4-acetyl-5-(4-ethoxy-3-methoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methyl}-1,2,4-triazine-3,5(2H,4H)-dione
6-{[4-acetyl-5-(4-ethoxy-3-methoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methyl}-1,2,4-triazine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | F076-0472 |
| Compound Name: | 6-{[4-acetyl-5-(4-ethoxy-3-methoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methyl}-1,2,4-triazine-3,5(2H,4H)-dione |
| Molecular Weight: | 389.37 |
| Molecular Formula: | C17 H19 N5 O6 |
| Smiles: | CCOc1ccc(cc1OC)C1N(C(C)=O)N=C(CC2C(NC(NN=2)=O)=O)O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5886 |
| logD: | 0.5615 |
| logSw: | -2.0123 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.809 |
| InChI Key: | NVNOXZMFLPHUNF-INIZCTEOSA-N |