1H-Purine-8-butanoic acid, 6-amino-
TL;DR: 1H-Purine-8-butanoic acid, 6-amino- (CAS 41785-03-9) is a chemical compound with molecular formula C9H11N5O2 and molecular weight 221.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(6-amino-7H-purin-8-yl)butanoic acid
Also Known As: 8-Carboxypropyladenine, 9H-Purine-8-butanoic acid, 6-amino-, 1H-Purine-8-butanoic acid, 6-amino-, 4-(6-Amino-1H-purin-8-yl)butanoic acid, 4-(6-amino-7H-purin-8-yl)butanoic acid
| Molecular Formula | C9H11N5O2 |
|---|---|
| Molecular Weight | 221.09 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.09128 |
| Heavy Atoms | 16 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 41785-03-9 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N=C(N2)CCCC(=O)O)N |
| InChIKey | PARGJUBOWZFJNQ-UHFFFAOYSA-N |
Product Overview
1H-Purine-8-butanoic acid, 6-amino- (CAS 41785-03-9), with molecular formula C9H11N5O2 and molecular weight 221.09 g/mol. IUPAC: 4-(6-amino-7H-purin-8-yl)butanoic acid.
Chemical Property Profile of 1H-Purine-8-butanoic acid, 6-amino-
Property Insights of 1H-Purine-8-butanoic acid, 6-amino-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Purine-8-butanoic acid, 6-amino-. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Purine-8-butanoic acid, 6-amino-. Following Lipinski's Rule of Five, 1H-Purine-8-butanoic acid, 6-amino- has 3 hydrogen bond donor(s) and 6 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-8-butanoic acid, 6-amino-?
The CAS number of 1H-Purine-8-butanoic acid, 6-amino- is 41785-03-9.
What is the molecular formula of 1H-Purine-8-butanoic acid, 6-amino-?
The molecular formula of 1H-Purine-8-butanoic acid, 6-amino- is C9H11N5O2.
What is the molecular weight of 1H-Purine-8-butanoic acid, 6-amino-?
The molecular weight of 1H-Purine-8-butanoic acid, 6-amino- is 221.09 g/mol.
Where can I buy 1H-Purine-8-butanoic acid, 6-amino-?
You can request a quote for 1H-Purine-8-butanoic acid, 6-amino- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Purine-8-butanoic acid, 6-amino-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Purine-8-butanoic acid, 6-amino- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.