2-(methylsulfanyl)-4-phenyl-6-[(prop-2-en-1-yl)amino]pyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-(methylsulfanyl)-4-phenyl-6-[(prop-2-en-1-yl)amino]pyrimidine-5-carbonitrile
2-(methylsulfanyl)-4-phenyl-6-[(prop-2-en-1-yl)amino]pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0477 |
| Compound Name: | 2-(methylsulfanyl)-4-phenyl-6-[(prop-2-en-1-yl)amino]pyrimidine-5-carbonitrile |
| Molecular Weight: | 282.36 |
| Molecular Formula: | C15 H14 N4 S |
| Smiles: | CSc1nc(c2ccccc2)c(C#N)c(NCC=C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3316 |
| logD: | 3.3316 |
| logSw: | -3.5714 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.074 |
| InChI Key: | KFZNCSOQNAGBPK-UHFFFAOYSA-N |