2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-(2-chlorophenoxy)-6-ethylpyrimidine
Chemical Structure Depiction of
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-(2-chlorophenoxy)-6-ethylpyrimidine
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-(2-chlorophenoxy)-6-ethylpyrimidine
Compound characteristics
| Compound ID: | V006-2494 |
| Compound Name: | 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-(2-chlorophenoxy)-6-ethylpyrimidine |
| Molecular Weight: | 412.98 |
| Molecular Formula: | C23 H25 Cl N2 O S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(C)(C)C)Oc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.444 |
| logD: | 7.444 |
| logSw: | -6.5858 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.4902 |
| InChI Key: | ISBCOLQQMCZPSN-UHFFFAOYSA-N |