N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-{4-[(3-methoxyphenyl)methoxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-methylpropanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-{4-[(3-methoxyphenyl)methoxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-methylpropanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-{4-[(3-methoxyphenyl)methoxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-methylpropanamide
Compound characteristics
| Compound ID: | V029-7664 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-{4-[(3-methoxyphenyl)methoxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-methylpropanamide |
| Molecular Weight: | 558.63 |
| Molecular Formula: | C31 H34 N4 O6 |
| Salt: | not_available |
| Smiles: | CN(CCc1ccc(c(c1)OC)OC)C(CCC1C(N=C(c2ccc(cc2)OCc2cccc(c2)OC)NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4505 |
| logD: | 2.5093 |
| logSw: | -3.7835 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.213 |
| InChI Key: | PTSBIQULLHUYKT-UHFFFAOYSA-N |