2-({[4-tert-butyl-6-(4-methylphenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
2-({[4-tert-butyl-6-(4-methylphenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
2-({[4-tert-butyl-6-(4-methylphenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V016-3270 |
| Compound Name: | 2-({[4-tert-butyl-6-(4-methylphenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C23 H23 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)Oc1cc(C(C)(C)C)nc(n1)SCc1ccccc1C#N |
| Stereo: | ACHIRAL |
| logP: | 6.4607 |
| logD: | 6.4607 |
| logSw: | -5.8337 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.965 |
| InChI Key: | LFNKLUVGKQQNTA-UHFFFAOYSA-N |