2-{[(3-chlorophenyl)methyl]sulfanyl}-4-(3,5-dimethylphenoxy)-6-ethylpyrimidine
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-4-(3,5-dimethylphenoxy)-6-ethylpyrimidine
2-{[(3-chlorophenyl)methyl]sulfanyl}-4-(3,5-dimethylphenoxy)-6-ethylpyrimidine
Compound characteristics
| Compound ID: | V007-7659 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-4-(3,5-dimethylphenoxy)-6-ethylpyrimidine |
| Molecular Weight: | 384.93 |
| Molecular Formula: | C21 H21 Cl N2 O S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1cccc(c1)[Cl])Oc1cc(C)cc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.8512 |
| logD: | 6.8512 |
| logSw: | -6.4086 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.4036 |
| InChI Key: | RVOVVQHSIMIMOP-UHFFFAOYSA-N |