N-benzyl-3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-methylpyrimidin-2-yl)sulfanyl]methyl}-N-methylbenzamide
Chemical Structure Depiction of
N-benzyl-3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-methylpyrimidin-2-yl)sulfanyl]methyl}-N-methylbenzamide
N-benzyl-3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-methylpyrimidin-2-yl)sulfanyl]methyl}-N-methylbenzamide
Compound characteristics
| Compound ID: | V003-5491 |
| Compound Name: | N-benzyl-3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-methylpyrimidin-2-yl)sulfanyl]methyl}-N-methylbenzamide |
| Molecular Weight: | 556.73 |
| Molecular Formula: | C32 H36 N4 O3 S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1cccc(c1)C(N(C)Cc1ccccc1)=O)N(C)CCc1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.5023 |
| logD: | 5.4988 |
| logSw: | -5.4385 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.874 |
| InChI Key: | BFGURVYSZRPSNN-UHFFFAOYSA-N |