8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS 93214-86-9) is a chemical compound with molecular formula C16H18N4O2 and molecular weight 298.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-8-(4-propan-2-ylphenyl)-7H-purine-2,6-dione
Also Known As: 1,3-dimethyl-8-(4-propan-2-ylphenyl)-7H-purine-2,6-dione, 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 1,3-dimethyl-8-p-cumenyl-7H-purine-2,6-quinone, AO-343/41780871, BRD-K37228907-001-07-8
| Molecular Formula | C16H18N4O2 |
|---|---|
| Molecular Weight | 298.14 g/mol |
| LogP | 1.7507 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.14297 |
| Heavy Atoms | 22 |
| Complexity | 958.70496 |
Chemical Identifiers
| CAS Number | 93214-86-9 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C |
Product Overview
8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS 93214-86-9), with molecular formula C16H18N4O2 and molecular weight 298.14 g/mol. IUPAC: 1,3-dimethyl-8-(4-propan-2-ylphenyl)-7H-purine-2,6-dione.
Chemical Property Profile of 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 1.7507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione has 1 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 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione is 93214-86-9.
What is the molecular formula of 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione is C16H18N4O2.
What is the molecular weight of 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione is 298.14 g/mol.
Where can I buy 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-(4-isopropylphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.