BAS 06208170
TL;DR: BAS 06208170 (CAS 511237-85-7) is a chemical compound with molecular formula C20H18N2O5 and molecular weight 366.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(1,3-benzodioxol-5-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
Also Known As: BAS 06208170, AP-845/42065376, 4-[5-(1,3-benzodioxol-5-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid, 4-(5-Benzo[1,3]dioxol-5-yl-3-phenyl-4,5-dihydro-pyrazol-1-yl)-4-oxo-butyric acid, 4-[3-(1,3-benzodioxol-5-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
| Molecular Formula | C20H18N2O5 |
|---|---|
| Molecular Weight | 366.12 g/mol |
| LogP | 2.9578 |
| Topological Polar Surface Area | 88.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.12158 |
| Heavy Atoms | 27 |
| Complexity | 909.843 |
Chemical Identifiers
| CAS Number | 511237-85-7 |
|---|---|
| SMILES | C1C(N(N=C1C2=CC=CC=C2)C(=O)CCC(=O)O)C3=CC4=C(C=C3)OCO4 |
Product Overview
BAS 06208170 (CAS 511237-85-7), with molecular formula C20H18N2O5 and molecular weight 366.12 g/mol. IUPAC: 4-[3-(1,3-benzodioxol-5-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid.
Chemical Property Profile of BAS 06208170
Property Insights of BAS 06208170
The XLogP value of 2.9578 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06208170. The TPSA of 88.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06208170. Following Lipinski's Rule of Five, BAS 06208170 has 1 hydrogen bond donor(s) and 5 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 06208170?
The CAS number of BAS 06208170 is 511237-85-7.
What is the molecular formula of BAS 06208170?
The molecular formula of BAS 06208170 is C20H18N2O5.
What is the molecular weight of BAS 06208170?
The molecular weight of BAS 06208170 is 366.12 g/mol.
Where can I buy BAS 06208170?
You can request a quote for BAS 06208170 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06208170?
Yes, KEHONG BIO provides custom synthesis services for BAS 06208170 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.