2-{[(2-methylphenyl)methyl]sulfanyl}-5,7-diphenylpyrido[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-methylphenyl)methyl]sulfanyl}-5,7-diphenylpyrido[2,3-d]pyrimidin-4(3H)-one
2-{[(2-methylphenyl)methyl]sulfanyl}-5,7-diphenylpyrido[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C202-0028 |
| Compound Name: | 2-{[(2-methylphenyl)methyl]sulfanyl}-5,7-diphenylpyrido[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 435.55 |
| Molecular Formula: | C27 H21 N3 O S |
| Smiles: | Cc1ccccc1CSC1NC(c2c(cc(c3ccccc3)nc2N=1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2697 |
| logD: | 7.0715 |
| logSw: | -5.7142 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.15 |
| InChI Key: | XVQSZXHEWWQXRX-UHFFFAOYSA-N |