3-(3-{4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-(3-{4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
3-(3-{4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | V020-8968 |
| Compound Name: | 3-(3-{4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide |
| Molecular Weight: | 579.05 |
| Molecular Formula: | C30 H31 Cl N4 O6 |
| Salt: | not_available |
| Smiles: | COc1ccc(CCNC(CCC2C(N=C(c3ccc(c(c3)OC)OCc3cccc(c3)[Cl])NN=2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.0016 |
| logD: | 3.0016 |
| logSw: | -3.5356 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.827 |
| InChI Key: | FXIBKYOMCAWLRK-UHFFFAOYSA-N |