BAS 13029759
TL;DR: BAS 13029759 (CAS 878728-77-9) is a chemical compound with molecular formula C23H27N5O4 and molecular weight 437.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,3-dimethyl-2-oxobutyl)-6-(2-ethoxyphenyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 13029759, F3124-0191, 2-(3,3-dimethyl-2-oxobutyl)-6-(2-ethoxyphenyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione, 3-(3,3-dimethyl-2-oxobutyl)-8-(2-ethoxyphenyl)-1,7-dimethyl-1H,2H,3H,4H,8H-imidazo[1,2-g]purine-2,4-dione, 3-(3,3-dimethyl-2-oxobutyl)-8-(2-ethoxyphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
| Molecular Formula | C23H27N5O4 |
|---|---|
| Molecular Weight | 437.21 g/mol |
| LogP | 2.46092 |
| Topological Polar Surface Area | 92.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.2063 |
| Heavy Atoms | 32 |
| Complexity | 1476.8224 |
Chemical Identifiers
| CAS Number | 878728-77-9 |
|---|---|
| SMILES | CCOC1=CC=CC=C1N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=O)C(C)(C)C)C |
Product Overview
BAS 13029759 (CAS 878728-77-9), with molecular formula C23H27N5O4 and molecular weight 437.21 g/mol. IUPAC: 2-(3,3-dimethyl-2-oxobutyl)-6-(2-ethoxyphenyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 13029759
Property Insights of BAS 13029759
The XLogP value of 2.46092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 13029759. The TPSA of 92.53 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13029759. Following Lipinski's Rule of Five, BAS 13029759 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 13029759?
The CAS number of BAS 13029759 is 878728-77-9.
What is the molecular formula of BAS 13029759?
The molecular formula of BAS 13029759 is C23H27N5O4.
What is the molecular weight of BAS 13029759?
The molecular weight of BAS 13029759 is 437.21 g/mol.
Where can I buy BAS 13029759?
You can request a quote for BAS 13029759 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13029759?
Yes, KEHONG BIO provides custom synthesis services for BAS 13029759 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.