TL;DR: 8-amino-1,3-dipropyl-7H-purine-2,6-dione (CAS 155930-14-6) is a chemical compound with molecular formula C11H17N5O2 and molecular weight 251.13823 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-amino-1,3-dipropyl-7H-purine-2,6-dione
Also Known As: 8-amino-1,3-dipropyl-7H-purine-2,6-dione, 8-amino-1,3-dipropyl-1H,3H,7H-purine-2,4-dione
| Molecular Formula | C11H17N5O2 |
| Molecular Weight | 251.13823 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 95.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.13823 Da |
| Heavy Atoms | 18 |
| Complexity | 348.0 |
| SMILES | CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)N |
| InChIKey | DVVSIPFUUNWPRT-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-amino-1,3-dipropyl-7H-purine-2,6-dione. The TPSA of 95.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-amino-1,3-dipropyl-7H-purine-2,6-dione. Following Lipinski's Rule of Five, 8-amino-1,3-dipropyl-7H-purine-2,6-dione has 2 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 8-amino-1,3-dipropyl-7H-purine-2,6-dione is 155930-14-6.
The molecular formula of 8-amino-1,3-dipropyl-7H-purine-2,6-dione is C11H17N5O2.
The molecular weight of 8-amino-1,3-dipropyl-7H-purine-2,6-dione is 251.13823 g/mol.
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