4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-(2-methylphenoxy)pyrimidine
Chemical Structure Depiction of
4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-(2-methylphenoxy)pyrimidine
4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-(2-methylphenoxy)pyrimidine
Compound characteristics
| Compound ID: | V002-0546 |
| Compound Name: | 4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-(2-methylphenoxy)pyrimidine |
| Molecular Weight: | 398.95 |
| Molecular Formula: | C22 H23 Cl N2 O S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1Oc1cc(C(C)(C)C)nc(n1)SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.2349 |
| logD: | 7.2349 |
| logSw: | -6.4099 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 23.9949 |
| InChI Key: | ALALNSQZYVBBJG-UHFFFAOYSA-N |