3-[3-(5-chloro-2-fluorophenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-[3-(5-chloro-2-fluorophenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
3-[3-(5-chloro-2-fluorophenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | V025-4024 |
| Compound Name: | 3-[3-(5-chloro-2-fluorophenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide |
| Molecular Weight: | 460.89 |
| Molecular Formula: | C22 H22 Cl F N4 O4 |
| Salt: | not_available |
| Smiles: | COc1ccc(CCNC(CCC2C(N=C(c3cc(ccc3F)[Cl])NN=2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.8745 |
| logD: | -1.1562 |
| logSw: | -3.182 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.882 |
| InChI Key: | VUTAYCGPJGCZRY-UHFFFAOYSA-N |