Abbott 81282
TL;DR: Abbott 81282 (CAS 16721-12-3) is a chemical compound with molecular formula C23H23N7O2 and molecular weight 429.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[butyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]pyrimidine-5-carboxylic acid
Also Known As: Abbott 81282, A-81282, A 81282, HY-101823A, 4-[butyl([2'-(1h-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl)amino]-5-pyrimidinecarboxylic acid
| Molecular Formula | C23H23N7O2 |
|---|---|
| Molecular Weight | 429.19 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 429.1913 |
| Heavy Atoms | 32 |
| Complexity | 587.0 |
Chemical Identifiers
| CAS Number | 16721-12-3 |
|---|---|
| SMILES | CCCCN(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3)C4=NC=NC=C4C(=O)O |
| InChIKey | AHZXSVWCNDLJER-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Abbott 81282 (CAS 16721-12-3), with molecular formula C23H23N7O2 and molecular weight 429.19 g/mol. IUPAC: 4-[butyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]pyrimidine-5-carboxylic acid.
Chemical Property Profile of Abbott 81282
Property Insights of Abbott 81282
The XLogP value of 3.8 indicates that Abbott 81282 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Abbott 81282. Following Lipinski's Rule of Five, Abbott 81282 has 2 hydrogen bond donor(s) and 8 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 Abbott 81282?
The CAS number of Abbott 81282 is 16721-12-3.
What is the molecular formula of Abbott 81282?
The molecular formula of Abbott 81282 is C23H23N7O2.
What is the molecular weight of Abbott 81282?
The molecular weight of Abbott 81282 is 429.19 g/mol.
Where can I buy Abbott 81282?
You can request a quote for Abbott 81282 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Abbott 81282?
Yes, KEHONG BIO provides custom synthesis services for Abbott 81282 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.