2,3-dimethylphenyl 5-chloro-2-[(3-methylphenyl)methanesulfonyl]pyrimidine-4-carboxylate
Chemical Structure Depiction of
2,3-dimethylphenyl 5-chloro-2-[(3-methylphenyl)methanesulfonyl]pyrimidine-4-carboxylate
2,3-dimethylphenyl 5-chloro-2-[(3-methylphenyl)methanesulfonyl]pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D491-0240 |
| Compound Name: | 2,3-dimethylphenyl 5-chloro-2-[(3-methylphenyl)methanesulfonyl]pyrimidine-4-carboxylate |
| Molecular Weight: | 430.91 |
| Molecular Formula: | C21 H19 Cl N2 O4 S |
| Smiles: | Cc1cccc(CS(c2ncc(c(C(=O)Oc3cccc(C)c3C)n2)[Cl])(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.175 |
| logD: | 5.175 |
| logSw: | -5.5955 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.881 |
| InChI Key: | WJTOHUJUDXPODT-UHFFFAOYSA-N |