3-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
3-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide
3-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | V028-1758 |
| Compound Name: | 3-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 478.66 |
| Molecular Formula: | C27 H34 N4 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1cc(nc(n1)SCc1cccc(c1)C(NCCOC)=O)N(C)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6989 |
| logD: | 5.6314 |
| logSw: | -5.4089 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.547 |
| InChI Key: | KAHFMBYBLOAXKH-UHFFFAOYSA-N |