3-[({4-chloro-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyrrolidin-1-yl)ethyl]benzamide
Chemical Structure Depiction of
3-[({4-chloro-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyrrolidin-1-yl)ethyl]benzamide
3-[({4-chloro-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyrrolidin-1-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V028-5860 |
| Compound Name: | 3-[({4-chloro-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyrrolidin-1-yl)ethyl]benzamide |
| Molecular Weight: | 448.03 |
| Molecular Formula: | C22 H30 Cl N5 O S |
| Salt: | not_available |
| Smiles: | CCCN(C)c1cc(nc(n1)SCc1cccc(c1)C(NCCN1CCCC1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0377 |
| logD: | 2.6295 |
| logSw: | -4.2827 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.398 |
| InChI Key: | NOFCERAWZDJYIX-UHFFFAOYSA-N |