BAS 12522431
TL;DR: BAS 12522431 (CAS 876901-40-5) is a chemical compound with molecular formula C20H23N5O2 and molecular weight 365.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-6-[(4-methylphenyl)methyl]-2-(2-methylprop-2-enyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12522431, F2582-0001, 1-methyl-8-[(4-methylphenyl)methyl]-3-(2-methylprop-2-enyl)-1,3,5-trihydroimid azolidino[1,2-h]purine-2,4-dione, 1-methyl-3-(2-methylallyl)-8-(4-methylbenzyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione, 4-methyl-6-[(4-methylphenyl)methyl]-2-(2-methylprop-2-enyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
| Molecular Formula | C20H23N5O2 |
|---|---|
| Molecular Weight | 365.19 g/mol |
| LogP | 1.80142 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.18518 |
| Heavy Atoms | 27 |
| Complexity | 1164.2759 |
Chemical Identifiers
| CAS Number | 876901-40-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=C)C |
Product Overview
BAS 12522431 (CAS 876901-40-5), with molecular formula C20H23N5O2 and molecular weight 365.19 g/mol. IUPAC: 4-methyl-6-[(4-methylphenyl)methyl]-2-(2-methylprop-2-enyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 12522431
Property Insights of BAS 12522431
The XLogP value of 1.80142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12522431. The TPSA of 65.06 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12522431. Following Lipinski's Rule of Five, BAS 12522431 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 12522431?
The CAS number of BAS 12522431 is 876901-40-5.
What is the molecular formula of BAS 12522431?
The molecular formula of BAS 12522431 is C20H23N5O2.
What is the molecular weight of BAS 12522431?
The molecular weight of BAS 12522431 is 365.19 g/mol.
Where can I buy BAS 12522431?
You can request a quote for BAS 12522431 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12522431?
Yes, KEHONG BIO provides custom synthesis services for BAS 12522431 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.