5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[(oxolan-2-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[(oxolan-2-yl)methyl]furan-2-carboxamide
5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[(oxolan-2-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | V023-6360 |
| Compound Name: | 5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[(oxolan-2-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 558.1 |
| Molecular Formula: | C27 H32 Cl N5 O4 S |
| Salt: | not_available |
| Smiles: | COCc1cc(nc(n1)SCc1ccc(C(NCC2CCCO2)=O)o1)N1CCN(CC1)c1ccccc1[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6892 |
| logD: | 4.6891 |
| logSw: | -4.7656 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.964 |
| InChI Key: | PNVMQCWXGJSVML-HXUWFJFHSA-N |