4-{[(3-benzyl-4-oxo-3,4-dihydropyrido[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}benzonitrile
Chemical Structure Depiction of
4-{[(3-benzyl-4-oxo-3,4-dihydropyrido[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}benzonitrile
4-{[(3-benzyl-4-oxo-3,4-dihydropyrido[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}benzonitrile
Compound characteristics
| Compound ID: | C724-0050 |
| Compound Name: | 4-{[(3-benzyl-4-oxo-3,4-dihydropyrido[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}benzonitrile |
| Molecular Weight: | 384.46 |
| Molecular Formula: | C22 H16 N4 O S |
| Smiles: | C(c1ccccc1)N1C(=Nc2c(cccn2)C1=O)SCc1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7624 |
| logD: | 3.7622 |
| logSw: | -4.1465 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.451 |
| InChI Key: | RMUVAWHBINTSRG-UHFFFAOYSA-N |