ChemDiv1_008638
TL;DR: ChemDiv1_008638 (CAS 381727-89-5) is a chemical compound with molecular formula C27H24N4O3S and molecular weight 484.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-(1,3-diphenylpyrazol-4-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid
Also Known As: ChemDiv1_008638, F0877-0123, 5-[1',3'-diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazole]-2-yl]-5-oxopentanoic acid, 5-(1',3'-diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl)-5-oxopentanoic acid, 5-[3-(1,3-diphenylpyrazol-4-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid
| Molecular Formula | C27H24N4O3S |
|---|---|
| Molecular Weight | 484.16 g/mol |
| LogP | 5.5334 |
| Topological Polar Surface Area | 87.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 484.15692 |
| Heavy Atoms | 35 |
| Complexity | 1347.8562 |
Chemical Identifiers
| CAS Number | 381727-89-5 |
|---|---|
| SMILES | C1C(N(N=C1C2=CC=CS2)C(=O)CCCC(=O)O)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
ChemDiv1_008638 (CAS 381727-89-5), with molecular formula C27H24N4O3S and molecular weight 484.16 g/mol. IUPAC: 5-[3-(1,3-diphenylpyrazol-4-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid.
Chemical Property Profile of ChemDiv1_008638
Property Insights of ChemDiv1_008638
The XLogP value of 5.5334 indicates that ChemDiv1_008638 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.79 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_008638. Following Lipinski's Rule of Five, ChemDiv1_008638 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_008638?
The CAS number of ChemDiv1_008638 is 381727-89-5.
What is the molecular formula of ChemDiv1_008638?
The molecular formula of ChemDiv1_008638 is C27H24N4O3S.
What is the molecular weight of ChemDiv1_008638?
The molecular weight of ChemDiv1_008638 is 484.16 g/mol.
Where can I buy ChemDiv1_008638?
You can request a quote for ChemDiv1_008638 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008638?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008638 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.