1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-
TL;DR: 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)- (CAS 75914-82-8) is a chemical compound with molecular formula C12H16N4O2 and molecular weight 248.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(cyclohexylmethyl)-7H-purine-2,6-dione
Also Known As: 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-, 3-(cyclohexylmethyl)-7H-purine-2,6-dione, 3,7-Dihydro-3-(cyclohexylmethyl)-1H-purine-2,6-dione, 3,7-dihydro-3-cyclohexylmethyl-1H-purine-2,6-dione, 3-(Cyclohexylmethyl)-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C12H16N4O2 |
|---|---|
| Molecular Weight | 248.13 g/mol |
| LogP | 0.9932 |
| Topological Polar Surface Area | 83.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.12732 |
| Heavy Atoms | 18 |
| Complexity | 660.5026 |
Chemical Identifiers
| CAS Number | 75914-82-8 |
|---|---|
| SMILES | C1CCC(CC1)CN2C3=C(C(=O)NC2=O)NC=N3 |
Product Overview
1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)- (CAS 75914-82-8), with molecular formula C12H16N4O2 and molecular weight 248.13 g/mol. IUPAC: 3-(cyclohexylmethyl)-7H-purine-2,6-dione.
Chemical Property Profile of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-
Property Insights of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-
The XLogP value of 0.9932 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-. The TPSA of 83.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-. Following Lipinski's Rule of Five, 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)- 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
Frequently Asked Questions
What is the CAS number of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-?
The CAS number of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)- is 75914-82-8.
What is the molecular formula of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-?
The molecular formula of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)- is C12H16N4O2.
What is the molecular weight of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-?
The molecular weight of 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)- is 248.13 g/mol.
Where can I buy 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-?
You can request a quote for 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Purine-2,6-dione, 3,7-dihydro-3-(cyclohexylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.