3-({[4-tert-butyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(pyridin-2-yl)ethyl]benzamide
Chemical Structure Depiction of
3-({[4-tert-butyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(pyridin-2-yl)ethyl]benzamide
3-({[4-tert-butyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(pyridin-2-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V026-6280 |
| Compound Name: | 3-({[4-tert-butyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(pyridin-2-yl)ethyl]benzamide |
| Molecular Weight: | 475.66 |
| Molecular Formula: | C27 H33 N5 O S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1cc(nc(n1)SCc1cccc(c1)C(NCCc1ccccn1)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.3364 |
| logD: | 5.3358 |
| logSw: | -5.2109 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.34 |
| InChI Key: | PTTKWXDSWLAOON-UHFFFAOYSA-N |