3-{4-[(butan-2-yl)oxy]phenyl}-6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
3-{4-[(butan-2-yl)oxy]phenyl}-6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]-1,2,4-triazin-5(2H)-one
3-{4-[(butan-2-yl)oxy]phenyl}-6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | V027-1207 |
| Compound Name: | 3-{4-[(butan-2-yl)oxy]phenyl}-6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C22 H30 N4 O3 |
| Salt: | not_available |
| Smiles: | CCC(C)Oc1ccc(cc1)C1NN=C(CCC(N2CCC(C)CC2)=O)C(N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1521 |
| logD: | 2.2108 |
| logSw: | -3.2702 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.386 |
| InChI Key: | UQJMGTBTQKCIAU-INIZCTEOSA-N |