3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one
TL;DR: 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one (CAS 131627-55-9) is a chemical compound with molecular formula C9H10N4O2 and molecular weight 206.08037 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(cyclopropylmethyl)-7H-purine-2,6-dione
Also Known As: 3-Cyclopropylmethylxanthine, 3-(cyclopropylmethyl)-7H-purine-2,6-dione, P 1432, 3,7-Dihydro-3-(cyclopropylmethyl)-1H-purine-2,6-dione, 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclopropylmethyl)-
Technical Specifications
| Molecular Formula | C9H10N4O2 |
| Molecular Weight | 206.08037 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 78.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.08037 Da |
| Heavy Atoms | 15 |
| Complexity | 315.0 |
| SMILES | C1CC1CN2C3=C(C(=O)NC2=O)NC=N3 |
| InChIKey | HWIMWAMLHNOMRW-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one
Property Insights of 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one. Following Lipinski's Rule of Five, 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one?
The CAS number of 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one is 131627-55-9.
What is the molecular formula of 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one?
The molecular formula of 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one is C9H10N4O2.
What is the molecular weight of 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one?
The molecular weight of 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one is 206.08037 g/mol.
Where can I buy 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one?
You can request a quote for 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one?
Yes, CoreyChem provides custom synthesis services for 3-(Cyclopropylmethyl)-6-hydroxy-3,9-dihydro-2H-purin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.