2-methylphenyl 5-chloro-2-[(2-methylphenyl)methanesulfonyl]pyrimidine-4-carboxylate
Chemical Structure Depiction of
2-methylphenyl 5-chloro-2-[(2-methylphenyl)methanesulfonyl]pyrimidine-4-carboxylate
2-methylphenyl 5-chloro-2-[(2-methylphenyl)methanesulfonyl]pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D650-0165 |
| Compound Name: | 2-methylphenyl 5-chloro-2-[(2-methylphenyl)methanesulfonyl]pyrimidine-4-carboxylate |
| Molecular Weight: | 416.88 |
| Molecular Formula: | C20 H17 Cl N2 O4 S |
| Smiles: | Cc1ccccc1CS(c1ncc(c(C(=O)Oc2ccccc2C)n1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7273 |
| logD: | 4.7273 |
| logSw: | -4.8741 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.881 |
| InChI Key: | UHLJJHHRLTYVBX-UHFFFAOYSA-N |