3-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}-6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
3-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}-6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]-1,2,4-triazin-5(2H)-one
3-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}-6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | V001-0810 |
| Compound Name: | 3-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}-6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 496.99 |
| Molecular Formula: | C26 H29 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | CC1CCN(CC1)C(CCC1C(N=C(c2ccc(c(c2)OC)OCc2ccccc2[Cl])NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4024 |
| logD: | 3.4024 |
| logSw: | -3.8798 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.645 |
| InChI Key: | MSUHUEOBOFLYEL-UHFFFAOYSA-N |