4-amino-N-benzyl-2-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-amino-N-benzyl-2-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)pyrimidine-5-carboxamide
4-amino-N-benzyl-2-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | M503-1213 |
| Compound Name: | 4-amino-N-benzyl-2-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)pyrimidine-5-carboxamide |
| Molecular Weight: | 411.51 |
| Molecular Formula: | C21 H29 N7 O2 |
| Smiles: | CC(C)NC(CN1CCN(CC1)c1ncc(C(NCc2ccccc2)=O)c(N)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1705 |
| logD: | 1.1663 |
| logSw: | -2.2613 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 94.078 |
| InChI Key: | NTCSYVKPUOHLRS-UHFFFAOYSA-N |