4-(3-methoxy-4-propoxyphenyl)-2-(methylsulfanyl)-6-(pyrrolidin-1-yl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(3-methoxy-4-propoxyphenyl)-2-(methylsulfanyl)-6-(pyrrolidin-1-yl)pyrimidine-5-carbonitrile
4-(3-methoxy-4-propoxyphenyl)-2-(methylsulfanyl)-6-(pyrrolidin-1-yl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0181 |
| Compound Name: | 4-(3-methoxy-4-propoxyphenyl)-2-(methylsulfanyl)-6-(pyrrolidin-1-yl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 384.5 |
| Molecular Formula: | C20 H24 N4 O2 S |
| Smiles: | CCCOc1ccc(cc1OC)c1c(C#N)c(nc(n1)SC)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.7537 |
| logD: | 4.7537 |
| logSw: | -4.718 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.973 |
| InChI Key: | CBSWLMAOUASUMO-UHFFFAOYSA-N |