7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
TL;DR: 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 374700-92-2) is a chemical compound with molecular formula C13H21N5O5 and molecular weight 327.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethyl]-1,3-dimethylpurine-2,6-dione
Also Known As: 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 7-(2-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}ethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 7-[2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethyl]-1,3-dimethyl-purine-2,6-dione, 7-[2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethyl]-1,3-dimethylpurine-2,6-dione
| Molecular Formula | C13H21N5O5 |
|---|---|
| Molecular Weight | 327.15 g/mol |
| LogP | -3.261 |
| Topological Polar Surface Area | 134.54 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 327.15427 |
| Heavy Atoms | 23 |
| Complexity | 793.1491 |
Chemical Identifiers
| CAS Number | 374700-92-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCNC(CO)(CO)CO |
Product Overview
7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 374700-92-2), with molecular formula C13H21N5O5 and molecular weight 327.15 g/mol. IUPAC: 7-[2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
Property Insights of 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of -3.261 indicates that 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 134.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione has 4 hydrogen bond donor(s) and 7 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 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is 374700-92-2.
What is the molecular formula of 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is C13H21N5O5.
What is the molecular weight of 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is 327.15 g/mol.
Where can I buy 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(2-((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)ethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.