BAS 12662409
TL;DR: BAS 12662409 (CAS 876669-99-7) is a chemical compound with molecular formula C19H18FN5O3 and molecular weight 383.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-fluorophenyl)-4,7-dimethyl-2-(3-oxobutan-2-yl)purino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12662409, UPCMLD0ENAT5804170:001, F2583-0055, 6-(4-fluorophenyl)-4,7-dimethyl-2-(3-oxobutan-2-yl)purino[7,8-a]imidazole-1,3-dione, 8-(4-fluorophenyl)-1,7-dimethyl-3-(3-oxobutan-2-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
| Molecular Formula | C19H18FN5O3 |
|---|---|
| Molecular Weight | 383.14 g/mol |
| LogP | 1.73612 |
| Topological Polar Surface Area | 83.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.13937 |
| Heavy Atoms | 28 |
| Complexity | 1371.578 |
Chemical Identifiers
| CAS Number | 876669-99-7 |
|---|---|
| SMILES | CC1=CN2C3=C(N=C2N1C4=CC=C(C=C4)F)N(C(=O)N(C3=O)C(C)C(=O)C)C |
Product Overview
BAS 12662409 (CAS 876669-99-7), with molecular formula C19H18FN5O3 and molecular weight 383.14 g/mol. IUPAC: 6-(4-fluorophenyl)-4,7-dimethyl-2-(3-oxobutan-2-yl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 12662409
Property Insights of BAS 12662409
The XLogP value of 1.73612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12662409. The TPSA of 83.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12662409. Following Lipinski's Rule of Five, BAS 12662409 has 0 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 BAS 12662409?
The CAS number of BAS 12662409 is 876669-99-7.
What is the molecular formula of BAS 12662409?
The molecular formula of BAS 12662409 is C19H18FN5O3.
What is the molecular weight of BAS 12662409?
The molecular weight of BAS 12662409 is 383.14 g/mol.
Where can I buy BAS 12662409?
You can request a quote for BAS 12662409 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12662409?
Yes, KEHONG BIO provides custom synthesis services for BAS 12662409 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.