A2777/0117550
TL;DR: A2777/0117550 (CAS 370575-76-1) is a chemical compound with molecular formula C17H16FN5O3 and molecular weight 357.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-fluorophenyl)-6-(2-hydroxyethyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: A2777/0117550, 7-(4-Fluorophenyl)-8-(2-hydroxyethyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(4-fluorophenyl)-6-(2-hydroxyethyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione, 2-(4-Fluoro-phenyl)-1-(2-hydroxy-ethyl)-5,7-dimethyl-1H,7H-1,3a,5,7,8-pentaaza-cyclopenta[a]indene-4,6-dione, 7-(4-fluorophenyl)-8-(2-hydroxyethyl)-1,3-dimethyl-1,3,5-trihydro-4-imidazolin o[1,2-h]purine-2,4-dione
| Molecular Formula | C17H16FN5O3 |
|---|---|
| Molecular Weight | 357.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.12372 |
| Heavy Atoms | 26 |
| Complexity | 585.0 |
Chemical Identifiers
| CAS Number | 370575-76-1 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCO)C4=CC=C(C=C4)F |
| InChIKey | VVVPBPQFVUJHCL-UHFFFAOYSA-N |
Product Overview
A2777/0117550 (CAS 370575-76-1), with molecular formula C17H16FN5O3 and molecular weight 357.12 g/mol. IUPAC: 7-(4-fluorophenyl)-6-(2-hydroxyethyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of A2777/0117550
Property Insights of A2777/0117550
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2777/0117550. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for A2777/0117550. Following Lipinski's Rule of Five, A2777/0117550 has 1 hydrogen bond donor(s) and 5 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 A2777/0117550?
The CAS number of A2777/0117550 is 370575-76-1.
What is the molecular formula of A2777/0117550?
The molecular formula of A2777/0117550 is C17H16FN5O3.
What is the molecular weight of A2777/0117550?
The molecular weight of A2777/0117550 is 357.12 g/mol.
Where can I buy A2777/0117550?
You can request a quote for A2777/0117550 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2777/0117550?
Yes, KEHONG BIO provides custom synthesis services for A2777/0117550 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.