N-ethyl-4-[({4-(methoxymethyl)-6-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-ethyl-4-[({4-(methoxymethyl)-6-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]benzamide
N-ethyl-4-[({4-(methoxymethyl)-6-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V004-6834 |
| Compound Name: | N-ethyl-4-[({4-(methoxymethyl)-6-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 517.69 |
| Molecular Formula: | C29 H35 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCNC(c1ccc(CSc2nc(COC)cc(n2)N2CCN(CC2)C/C=C/c2ccccc2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.566 |
| logD: | 4.5528 |
| logSw: | -4.3534 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.925 |
| InChI Key: | ATZIXNHMHRMHQN-UHFFFAOYSA-N |