6-amino-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,2-dihydropyridine-3,5-dicarbonitrile
Chemical Structure Depiction of
6-amino-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,2-dihydropyridine-3,5-dicarbonitrile
6-amino-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,2-dihydropyridine-3,5-dicarbonitrile
Compound characteristics
| Compound ID: | 8008-8817 |
| Compound Name: | 6-amino-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,2-dihydropyridine-3,5-dicarbonitrile |
| Molecular Weight: | 342.37 |
| Molecular Formula: | C16 H14 N4 O3 S |
| Smiles: | COc1cc(cc(c1OC)OC)C1=C(C#N)C(NC(=C1C#N)N)=S |
| Stereo: | ACHIRAL |
| logP: | 1.2717 |
| logD: | -1.8742 |
| logSw: | -2.2852 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.177 |
| InChI Key: | HJHHFEUMAYTLCM-UHFFFAOYSA-N |