BAS 02982857
TL;DR: BAS 02982857 (CAS 402947-58-4) is a chemical compound with molecular formula C22H23FN2O5 and molecular weight 414.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[5-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid
Also Known As: BAS 02982857, AB00121138-01, 5-[3-(3,4-dimethoxyphenyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid, 5-[5-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid, 5-(3-(3,4-dimethoxyphenyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)-5-oxopentanoic acid
| Molecular Formula | C22H23FN2O5 |
|---|---|
| Molecular Weight | 414.16 g/mol |
| LogP | 3.7755 |
| Topological Polar Surface Area | 88.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 414.1591 |
| Heavy Atoms | 30 |
| Complexity | 975.7503 |
Chemical Identifiers
| CAS Number | 402947-58-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3F)C(=O)CCCC(=O)O)OC |
Product Overview
BAS 02982857 (CAS 402947-58-4), with molecular formula C22H23FN2O5 and molecular weight 414.16 g/mol. IUPAC: 5-[5-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid.
Chemical Property Profile of BAS 02982857
Property Insights of BAS 02982857
The XLogP value of 3.7755 indicates that BAS 02982857 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02982857. Following Lipinski's Rule of Five, BAS 02982857 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 02982857?
The CAS number of BAS 02982857 is 402947-58-4.
What is the molecular formula of BAS 02982857?
The molecular formula of BAS 02982857 is C22H23FN2O5.
What is the molecular weight of BAS 02982857?
The molecular weight of BAS 02982857 is 414.16 g/mol.
Where can I buy BAS 02982857?
You can request a quote for BAS 02982857 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02982857?
Yes, KEHONG BIO provides custom synthesis services for BAS 02982857 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.