1-{4-[(6-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}pyrimidin-4-yl)oxy]phenyl}ethan-1-one
Chemical Structure Depiction of
1-{4-[(6-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}pyrimidin-4-yl)oxy]phenyl}ethan-1-one
1-{4-[(6-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}pyrimidin-4-yl)oxy]phenyl}ethan-1-one
Compound characteristics
| Compound ID: | V006-0926 |
| Compound Name: | 1-{4-[(6-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}pyrimidin-4-yl)oxy]phenyl}ethan-1-one |
| Molecular Weight: | 426.96 |
| Molecular Formula: | C23 H23 Cl N2 O2 S |
| Salt: | not_available |
| Smiles: | CC(c1ccc(cc1)Oc1cc(C(C)(C)C)nc(n1)SCc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4324 |
| logD: | 6.4324 |
| logSw: | -6.306 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.735 |
| InChI Key: | DSJPWHMECLPYRS-UHFFFAOYSA-N |