1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione (CAS 510717-13-2) is a chemical compound with molecular formula C18H23N5O2 and molecular weight 341.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-8-(2-phenylethylamino)-7-propylpurine-2,6-dione
Also Known As: BAS 04358650, AB01305591-01, 1,3-dimethyl-8-(phenethylamino)-7-propylpurine-2,6-dione, 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione, 1,3-dimethyl-8-(phenethylamino)-7-propyl-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C18H23N5O2 |
|---|---|
| Molecular Weight | 341.19 g/mol |
| LogP | 1.4983 |
| Topological Polar Surface Area | 73.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 341.18518 |
| Heavy Atoms | 25 |
| Complexity | 998.2088 |
Chemical Identifiers
| CAS Number | 510717-13-2 |
|---|---|
| SMILES | CCCN1C2=C(N=C1NCCC3=CC=CC=C3)N(C(=O)N(C2=O)C)C |
Product Overview
1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione (CAS 510717-13-2), with molecular formula C18H23N5O2 and molecular weight 341.19 g/mol. IUPAC: 1,3-dimethyl-8-(2-phenylethylamino)-7-propylpurine-2,6-dione.
Chemical Property Profile of 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 1.4983 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 73.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione has 1 hydrogen bond donor(s) and 4 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 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione is 510717-13-2.
What is the molecular formula of 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione is C18H23N5O2.
What is the molecular weight of 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione is 341.19 g/mol.
Where can I buy 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-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 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-dimethyl-8-[(2-phenylethyl)amino]-7-propyl-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.