2-(3-chlorophenyl)-5-(2-hydroxyethyl)-6-methyl-3-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-5-(2-hydroxyethyl)-6-methyl-3-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}pyrimidin-4(3H)-one
2-(3-chlorophenyl)-5-(2-hydroxyethyl)-6-methyl-3-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | T604-0589 |
| Compound Name: | 2-(3-chlorophenyl)-5-(2-hydroxyethyl)-6-methyl-3-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 449.94 |
| Molecular Formula: | C25 H24 Cl N3 O3 |
| Smiles: | CC1=C(CCO)C(N(Cc2c(C)oc(c3cccc(C)c3)n2)C(c2cccc(c2)[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9896 |
| logD: | 3.9892 |
| logSw: | -4.2563 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.779 |
| InChI Key: | QBDZFGMUSSCWIE-UHFFFAOYSA-N |