4-[({4-[benzyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-[({4-[benzyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-2-yl)methyl]benzamide
4-[({4-[benzyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V031-1279 |
| Compound Name: | 4-[({4-[benzyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-2-yl)methyl]benzamide |
| Molecular Weight: | 483.64 |
| Molecular Formula: | C28 H29 N5 O S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(NCc1ccccn1)=O)N(C)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1825 |
| logD: | 5.139 |
| logSw: | -5.0349 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.13 |
| InChI Key: | CTPQGPQWCHZPDW-UHFFFAOYSA-N |