3-[3-(cyclopropylmethoxy)phenyl]-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
3-[3-(cyclopropylmethoxy)phenyl]-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-1,2,4-triazin-5(2H)-one
3-[3-(cyclopropylmethoxy)phenyl]-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | V004-6169 |
| Compound Name: | 3-[3-(cyclopropylmethoxy)phenyl]-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C20 H24 N4 O3 S |
| Salt: | not_available |
| Smiles: | C(CC(N1CCSCC1)=O)C1C(N=C(c2cccc(c2)OCC2CC2)NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.733 |
| logD: | 1.733 |
| logSw: | -2.4482 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.451 |
| InChI Key: | MDPJRMZODGOYBZ-UHFFFAOYSA-N |