TL;DR: 1-(4,6-dimethyl-2-pyrimidinyl)-D-Proline (CAS 1217817-21-4) is a chemical compound with molecular formula C11H15N3O2 and molecular weight 221.11642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2-carboxylic acid
Also Known As: 1-(4,6-dimethyl-2-pyrimidinyl)-D-Proline, BAS 13695128, (2R)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2-carboxylic acid
| Molecular Formula | C11H15N3O2 |
| Molecular Weight | 221.11642 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 66.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.11642 Da |
| Heavy Atoms | 16 |
| Complexity | 262.0 |
| SMILES | CC1=CC(=NC(=N1)N2CCC[C@@H]2C(=O)O)C |
| InChIKey | QYEOBTIRZQUURJ-SECBINFHSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4,6-dimethyl-2-pyrimidinyl)-D-Proline. The TPSA of 66.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4,6-dimethyl-2-pyrimidinyl)-D-Proline. Following Lipinski's Rule of Five, 1-(4,6-dimethyl-2-pyrimidinyl)-D-Proline has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(4,6-dimethyl-2-pyrimidinyl)-D-Proline is 1217817-21-4.
The molecular formula of 1-(4,6-dimethyl-2-pyrimidinyl)-D-Proline is C11H15N3O2.
The molecular weight of 1-(4,6-dimethyl-2-pyrimidinyl)-D-Proline is 221.11642 g/mol.
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