BAS 12524396
TL;DR: BAS 12524396 (CAS 876902-52-2) is a chemical compound with molecular formula C22H25N5O3 and molecular weight 407.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-(2-methylprop-2-enyl)purino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12524396, 8-(4-methoxybenzyl)-1,6,7-trimethyl-3-(2-methylallyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, F2582-0271, 6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-(2-methylprop-2-enyl)purino[7,8-a]imidazole-1,3-dione, 8-(4-methoxybenzyl)-1,6,7-trimethyl-3-(2-methylprop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
| Molecular Formula | C22H25N5O3 |
|---|---|
| Molecular Weight | 407.20 g/mol |
| LogP | 2.39924 |
| Topological Polar Surface Area | 75.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.19574 |
| Heavy Atoms | 30 |
| Complexity | 1414.2522 |
Chemical Identifiers
| CAS Number | 876902-52-2 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CC4=CC=C(C=C4)OC)N(C(=O)N(C3=O)CC(=C)C)C)C |
Product Overview
BAS 12524396 (CAS 876902-52-2), with molecular formula C22H25N5O3 and molecular weight 407.20 g/mol. IUPAC: 6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-(2-methylprop-2-enyl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 12524396
Property Insights of BAS 12524396
The XLogP value of 2.39924 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12524396. The TPSA of 75.46 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12524396. Following Lipinski's Rule of Five, BAS 12524396 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 12524396?
The CAS number of BAS 12524396 is 876902-52-2.
What is the molecular formula of BAS 12524396?
The molecular formula of BAS 12524396 is C22H25N5O3.
What is the molecular weight of BAS 12524396?
The molecular weight of BAS 12524396 is 407.20 g/mol.
Where can I buy BAS 12524396?
You can request a quote for BAS 12524396 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12524396?
Yes, KEHONG BIO provides custom synthesis services for BAS 12524396 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.