3-(3-{4-[(3-chlorophenyl)methoxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-(3-{4-[(3-chlorophenyl)methoxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
3-(3-{4-[(3-chlorophenyl)methoxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | V020-8938 |
| Compound Name: | 3-(3-{4-[(3-chlorophenyl)methoxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(4-methoxyphenyl)ethyl]propanamide |
| Molecular Weight: | 519 |
| Molecular Formula: | C28 H27 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | COc1ccc(CCNC(CCC2C(N=C(c3ccc(cc3)OCc3cccc(c3)[Cl])NN=2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7935 |
| logD: | 2.8522 |
| logSw: | -4.3091 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.393 |
| InChI Key: | LYALSQFYSLOXQS-UHFFFAOYSA-N |