2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-(3-chlorophenoxy)-6-methylpyrimidine
Chemical Structure Depiction of
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-(3-chlorophenoxy)-6-methylpyrimidine
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-(3-chlorophenoxy)-6-methylpyrimidine
Compound characteristics
| Compound ID: | V008-3979 |
| Compound Name: | 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-(3-chlorophenoxy)-6-methylpyrimidine |
| Molecular Weight: | 398.95 |
| Molecular Formula: | C22 H23 Cl N2 O S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1ccc(cc1)C(C)(C)C)Oc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.0184 |
| logD: | 7.0184 |
| logSw: | -6.5509 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 23.7147 |
| InChI Key: | XYSXJDSGIPWNJF-UHFFFAOYSA-N |