3-(3-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(thiophen-2-yl)ethyl]propanamide
Chemical Structure Depiction of
3-(3-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(thiophen-2-yl)ethyl]propanamide
3-(3-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(thiophen-2-yl)ethyl]propanamide
Compound characteristics
| Compound ID: | V020-8898 |
| Compound Name: | 3-(3-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)-N-[2-(thiophen-2-yl)ethyl]propanamide |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C22 H24 N4 O4 S |
| Salt: | not_available |
| Smiles: | COc1cc(ccc1OCC=C)C1NN=C(CCC(NCCc2cccs2)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9813 |
| logD: | 1.9813 |
| logSw: | -2.6567 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.774 |
| InChI Key: | UNUNJPVMARGPLM-UHFFFAOYSA-N |