BAS 01289634
TL;DR: BAS 01289634 (CAS 312586-94-0) is a chemical compound with molecular formula C20H19BrN2O4 and molecular weight 430.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-(4-bromophenyl)-3-(2-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
Also Known As: BAS 01289634, BIM-0039325.P001, 4-(3-(4-bromophenyl)-5-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)-4-oxobutanoic acid, 4-[3-(4-bromophenyl)-5-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid, F0477-0077
| Molecular Formula | C20H19BrN2O4 |
|---|---|
| Molecular Weight | 430.05 g/mol |
| LogP | 4.0002 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.05283 |
| Heavy Atoms | 27 |
| Complexity | 879.80536 |
Chemical Identifiers
| CAS Number | 312586-94-0 |
|---|---|
| SMILES | COC1=CC=CC=C1C2CC(=NN2C(=O)CCC(=O)O)C3=CC=C(C=C3)Br |
Product Overview
BAS 01289634 (CAS 312586-94-0), with molecular formula C20H19BrN2O4 and molecular weight 430.05 g/mol. IUPAC: 4-[5-(4-bromophenyl)-3-(2-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid.
Chemical Property Profile of BAS 01289634
Property Insights of BAS 01289634
The XLogP value of 4.0002 indicates that BAS 01289634 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01289634. Following Lipinski's Rule of Five, BAS 01289634 has 1 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 01289634?
The CAS number of BAS 01289634 is 312586-94-0.
What is the molecular formula of BAS 01289634?
The molecular formula of BAS 01289634 is C20H19BrN2O4.
What is the molecular weight of BAS 01289634?
The molecular weight of BAS 01289634 is 430.05 g/mol.
Where can I buy BAS 01289634?
You can request a quote for BAS 01289634 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01289634?
Yes, KEHONG BIO provides custom synthesis services for BAS 01289634 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.