BAS 12522274
TL;DR: BAS 12522274 (CAS 872839-77-5) is a chemical compound with molecular formula C17H18FN5O3 and molecular weight 359.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-fluorophenyl)-2-(2-methoxyethyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12522274, F2000-0415, 8-(4-fluorophenyl)-3-(2-methoxyethyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione, 6-(4-fluorophenyl)-2-(2-methoxyethyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione, 8-(4-fluorophenyl)-3-(2-methoxyethyl)-1-methyl-1,3,5-trihydroimidazolidino[1,2 -h]purine-2,4-dione
| Molecular Formula | C17H18FN5O3 |
|---|---|
| Molecular Weight | 359.14 g/mol |
| LogP | 0.8339 |
| Topological Polar Surface Area | 74.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.13937 |
| Heavy Atoms | 26 |
| Complexity | 1096.7594 |
Chemical Identifiers
| CAS Number | 872839-77-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)CCOC)N3CCN(C3=N2)C4=CC=C(C=C4)F |
Product Overview
BAS 12522274 (CAS 872839-77-5), with molecular formula C17H18FN5O3 and molecular weight 359.14 g/mol. IUPAC: 6-(4-fluorophenyl)-2-(2-methoxyethyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 12522274
Property Insights of BAS 12522274
The XLogP value of 0.8339 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12522274. The TPSA of 74.29 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12522274. Following Lipinski's Rule of Five, BAS 12522274 has 0 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 BAS 12522274?
The CAS number of BAS 12522274 is 872839-77-5.
What is the molecular formula of BAS 12522274?
The molecular formula of BAS 12522274 is C17H18FN5O3.
What is the molecular weight of BAS 12522274?
The molecular weight of BAS 12522274 is 359.14 g/mol.
Where can I buy BAS 12522274?
You can request a quote for BAS 12522274 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12522274?
Yes, KEHONG BIO provides custom synthesis services for BAS 12522274 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.