2-(3-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)carbamoyl}phenyl)-N-[3-(dimethylamino)-2,2-dimethylpropyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(3-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)carbamoyl}phenyl)-N-[3-(dimethylamino)-2,2-dimethylpropyl]pyrimidine-5-carboxamide
2-(3-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)carbamoyl}phenyl)-N-[3-(dimethylamino)-2,2-dimethylpropyl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | V015-4081 |
| Compound Name: | 2-(3-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)carbamoyl}phenyl)-N-[3-(dimethylamino)-2,2-dimethylpropyl]pyrimidine-5-carboxamide |
| Molecular Weight: | 533.67 |
| Molecular Formula: | C30 H39 N5 O4 |
| Salt: | not_available |
| Smiles: | CC(C)(CNC(c1cnc(c2cccc(c2)C(N(C)CCc2ccc(c(c2)OC)OC)=O)nc1)=O)CN(C)C |
| Stereo: | ACHIRAL |
| logP: | 2.4482 |
| logD: | -0.0031 |
| logSw: | -2.7401 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.543 |
| InChI Key: | HYYDCWHDKRQOKO-UHFFFAOYSA-N |