4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-phenylpyrimidin-2-yl)sulfanyl]methyl}-N-[(furan-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-phenylpyrimidin-2-yl)sulfanyl]methyl}-N-[(furan-2-yl)methyl]benzamide
4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-phenylpyrimidin-2-yl)sulfanyl]methyl}-N-[(furan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V027-5256 |
| Compound Name: | 4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-phenylpyrimidin-2-yl)sulfanyl]methyl}-N-[(furan-2-yl)methyl]benzamide |
| Molecular Weight: | 594.73 |
| Molecular Formula: | C34 H34 N4 O4 S |
| Salt: | not_available |
| Smiles: | CN(CCc1ccc(c(c1)OC)OC)c1cc(c2ccccc2)nc(n1)SCc1ccc(cc1)C(NCc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5669 |
| logD: | 6.5636 |
| logSw: | -5.7284 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.808 |
| InChI Key: | BLGTWZQLIFFSQP-UHFFFAOYSA-N |