1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione
TL;DR: 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione (CAS 879438-96-7) is a chemical compound with molecular formula C17H17N5O2 and molecular weight 323.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7-dimethyl-6-[(4-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione
Also Known As: 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione, 4,7-dimethyl-6-[(4-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione, 1,7-dimethyl-8-(4-methylbenzyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 4-hydroxy-1,7-dimethyl-8-(4-methylbenzyl)-1H-imidazo[2,1-f]purin-2(8H)-one
| Molecular Formula | C17H17N5O2 |
|---|---|
| Molecular Weight | 323.14 g/mol |
| LogP | 1.34114 |
| Topological Polar Surface Area | 77.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.1382 |
| Heavy Atoms | 24 |
| Complexity | 1188.3835 |
Chemical Identifiers
| CAS Number | 879438-96-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C(=CN3C2=NC4=C3C(=O)NC(=O)N4C)C |
Product Overview
1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione (CAS 879438-96-7), with molecular formula C17H17N5O2 and molecular weight 323.14 g/mol. IUPAC: 4,7-dimethyl-6-[(4-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione
Property Insights of 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione
The XLogP value of 1.34114 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione. The TPSA of 77.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione. Following Lipinski's Rule of Five, 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-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 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione?
The CAS number of 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione is 879438-96-7.
What is the molecular formula of 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione?
The molecular formula of 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione is C17H17N5O2.
What is the molecular weight of 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione?
The molecular weight of 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione is 323.14 g/mol.
Where can I buy 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione?
You can request a quote for 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,7-dimethyl-8-[(4-methylphenyl)methyl]-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.