BAS 12532601
TL;DR: BAS 12532601 (CAS 876667-13-9) is a chemical compound with molecular formula C17H18N4O3 and molecular weight 326.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid
Also Known As: BAS 12532601, N-(1-Ethyl-7-methyl-1H-pyrazolo[3,4-b]quinolin-3-yl)-succinamic acid, 4-((1-ethyl-7-methyl-1H-pyrazolo[3,4-b]quinolin-3-yl)amino)-4-oxobutanoic acid, 4-[(1-ethyl-7-methyl-1H-pyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid, 4-[(1-ethyl-7-methylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid
| Molecular Formula | C17H18N4O3 |
|---|---|
| Molecular Weight | 326.14 g/mol |
| LogP | 2.71612 |
| Topological Polar Surface Area | 97.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.13788 |
| Heavy Atoms | 24 |
| Complexity | 945.8043 |
Chemical Identifiers
| CAS Number | 876667-13-9 |
|---|---|
| SMILES | CCN1C2=C(C=C3C=CC(=CC3=N2)C)C(=N1)NC(=O)CCC(=O)O |
Product Overview
BAS 12532601 (CAS 876667-13-9), with molecular formula C17H18N4O3 and molecular weight 326.14 g/mol. IUPAC: 4-[(1-ethyl-7-methylpyrazolo[5,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid.
Chemical Property Profile of BAS 12532601
Property Insights of BAS 12532601
The XLogP value of 2.71612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12532601. The TPSA of 97.11 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12532601. Following Lipinski's Rule of Five, BAS 12532601 has 2 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 12532601?
The CAS number of BAS 12532601 is 876667-13-9.
What is the molecular formula of BAS 12532601?
The molecular formula of BAS 12532601 is C17H18N4O3.
What is the molecular weight of BAS 12532601?
The molecular weight of BAS 12532601 is 326.14 g/mol.
Where can I buy BAS 12532601?
You can request a quote for BAS 12532601 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12532601?
Yes, KEHONG BIO provides custom synthesis services for BAS 12532601 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.