4-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
4-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(propan-2-yl)benzamide
4-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | V029-6486 |
| Compound Name: | 4-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(propan-2-yl)benzamide |
| Molecular Weight: | 384.54 |
| Molecular Formula: | C21 H28 N4 O S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(NC(C)C)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.3512 |
| logD: | 4.3508 |
| logSw: | -4.1713 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.696 |
| InChI Key: | RLIATRGUAOECRS-UHFFFAOYSA-N |