N-benzyl-5-[({4-(methoxymethyl)-6-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-methylfuran-2-carboxamide
Chemical Structure Depiction of
N-benzyl-5-[({4-(methoxymethyl)-6-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-methylfuran-2-carboxamide
N-benzyl-5-[({4-(methoxymethyl)-6-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-methylfuran-2-carboxamide
Compound characteristics
| Compound ID: | V026-2101 |
| Compound Name: | N-benzyl-5-[({4-(methoxymethyl)-6-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-methylfuran-2-carboxamide |
| Molecular Weight: | 583.75 |
| Molecular Formula: | C33 H37 N5 O3 S |
| Salt: | not_available |
| Smiles: | CN(Cc1ccccc1)C(c1ccc(CSc2nc(COC)cc(n2)N2CCN(CC2)C/C=C/c2ccccc2)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3455 |
| logD: | 6.3322 |
| logSw: | -5.4503 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.606 |
| InChI Key: | QRLMZMXOEAUFGK-UHFFFAOYSA-N |