TL;DR: 4-N,6-N-diethyl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine (CAS 1027-41-4) is a chemical compound with molecular formula C9H14N6 and molecular weight 206.12799 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-N,6-N-diethyl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine
Also Known As: 5-Nitro-4-amino-6-dimethylamino-pyrimidin, n,n'-diethyl-1h-pyrazolo[3,4-d]pyrimidine-4,6-diamine, 4-N,6-N-diethyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine, N~4~,N~6~-Diethyl-1H-pyrazolo[3,4-d]pyrimidine-4,6(2H,5H)-diimine
| Molecular Formula | C9H14N6 |
| Molecular Weight | 206.12799 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 78.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.12799 Da |
| Heavy Atoms | 15 |
| Complexity | 199.0 |
| SMILES | CCNC1=NC(=NC2=C1C=NN2)NCC |
| InChIKey | UFBCYFATXXBOMD-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-N,6-N-diethyl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-N,6-N-diethyl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine. Following Lipinski's Rule of Five, 4-N,6-N-diethyl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine has 3 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 4-N,6-N-diethyl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine is 1027-41-4.
The molecular formula of 4-N,6-N-diethyl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine is C9H14N6.
The molecular weight of 4-N,6-N-diethyl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine is 206.12799 g/mol.
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