5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]furan-2-carboxamide
Chemical Structure Depiction of
5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]furan-2-carboxamide
5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | V023-6351 |
| Compound Name: | 5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]furan-2-carboxamide |
| Molecular Weight: | 579.12 |
| Molecular Formula: | C29 H31 Cl N6 O3 S |
| Salt: | not_available |
| Smiles: | COCc1cc(nc(n1)SCc1ccc(C(NCCc2ccccn2)=O)o1)N1CCN(CC1)c1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1642 |
| logD: | 5.164 |
| logSw: | -5.5711 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.694 |
| InChI Key: | NWMYTPNCVWXWFA-UHFFFAOYSA-N |