2-{[(4-tert-butylphenyl)methyl]sulfanyl}-6-ethyl-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-6-ethyl-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-6-ethyl-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V007-6570 |
| Compound Name: | 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-6-ethyl-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 420.62 |
| Molecular Formula: | C26 H32 N2 O S |
| Smiles: | CCC1=C(Cc2cccc(C)c2)C(N(C)C(=N1)SCc1ccc(cc1)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6032 |
| logD: | 6.6032 |
| logSw: | -5.6097 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.7951 |
| InChI Key: | OCKRWXIABAGZGT-UHFFFAOYSA-N |