TL;DR: 2,4-Pyrimidinediamine, 6-chloro-N,N,N',N'-tetramethyl- (CAS 1202-22-8) is a chemical compound with molecular formula C8H13ClN4 and molecular weight 200.08287 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-2-N,2-N,4-N,4-N-tetramethylpyrimidine-2,4-diamine
Also Known As: 4-CHLORO-2,6-BIS(DIMETHYLAMINO)PYRIMIDINE, 6-chloro-N2,N2,N4,N4-tetramethylpyrimidine-2,4-diamine, 4-Chloro-2,6-dimethylamino-pyrimidine, AI3-51893, 2,4-Pyrimidinediamine, 6-chloro-N,N,N',N'-tetramethyl-
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H13ClN4 |
| Molecular Weight | 200.08287 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.08287 Da |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
| SMILES | CN(C)C1=CC(=NC(=N1)N(C)C)Cl |
| InChIKey | WOYUZQVWDISJCF-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Pyrimidinediamine, 6-chloro-N,N,N',N'-tetramethyl-. With a topological polar surface area (TPSA) of 32.3 Ų, 2,4-Pyrimidinediamine, 6-chloro-N,N,N',N'-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Pyrimidinediamine, 6-chloro-N,N,N',N'-tetramethyl- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,4-Pyrimidinediamine, 6-chloro-N,N,N',N'-tetramethyl- is 1202-22-8.
The molecular formula of 2,4-Pyrimidinediamine, 6-chloro-N,N,N',N'-tetramethyl- is C8H13ClN4.
The molecular weight of 2,4-Pyrimidinediamine, 6-chloro-N,N,N',N'-tetramethyl- is 200.08287 g/mol.
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