4-(4-chlorophenyl)-6-[(3-hydroxypropyl)amino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-chlorophenyl)-6-[(3-hydroxypropyl)amino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(4-chlorophenyl)-6-[(3-hydroxypropyl)amino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D287-0142 |
| Compound Name: | 4-(4-chlorophenyl)-6-[(3-hydroxypropyl)amino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 334.82 |
| Molecular Formula: | C15 H15 Cl N4 O S |
| Smiles: | CSc1nc(c2ccc(cc2)[Cl])c(C#N)c(NCCCO)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0923 |
| logD: | 3.0923 |
| logSw: | -3.7469 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.73 |
| InChI Key: | CEDHNDKZZISSIU-UHFFFAOYSA-N |