3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1-(4-ethoxyphenyl)pyrazin-2(1H)-one
Chemical Structure Depiction of
3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1-(4-ethoxyphenyl)pyrazin-2(1H)-one
3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1-(4-ethoxyphenyl)pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G194-0547 |
| Compound Name: | 3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1-(4-ethoxyphenyl)pyrazin-2(1H)-one |
| Molecular Weight: | 365.39 |
| Molecular Formula: | C20 H19 N3 O4 |
| Smiles: | CCOc1ccc(cc1)N1C=CN=C(C1=O)NCc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 1.9449 |
| logD: | 1.9448 |
| logSw: | -2.5885 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.54 |
| InChI Key: | SSHIWYUOLRFCBO-UHFFFAOYSA-N |