1-(4-{4-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-2-(dimethylamino)pyrimidine-5-carbonyl}piperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-2-(dimethylamino)pyrimidine-5-carbonyl}piperazin-1-yl)ethan-1-one
1-(4-{4-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-2-(dimethylamino)pyrimidine-5-carbonyl}piperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | SA01-0336 |
| Compound Name: | 1-(4-{4-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-2-(dimethylamino)pyrimidine-5-carbonyl}piperazin-1-yl)ethan-1-one |
| Molecular Weight: | 414.51 |
| Molecular Formula: | C21 H30 N6 O3 |
| Smiles: | CC(N1CCN(CC1)C(c1cnc(nc1C1CCN(C1)C(C1CC1)=O)N(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7196 |
| logD: | 0.7195 |
| logSw: | -1.5496 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.877 |
| InChI Key: | BYQJRDQHBORMDT-INIZCTEOSA-N |