ChemDiv1_008768
TL;DR: ChemDiv1_008768 (CAS 402950-87-2) is a chemical compound with molecular formula C24H24N2O5S and molecular weight 452.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone
Also Known As: ChemDiv1_008768, BAS 02982914, (5-(2,3-dimethoxyphenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)(thiophen-2-yl)methanone, F0877-0087, 5-(2,3-dimethoxyphenyl)-3-(3,4-dimethoxyphenyl)-1-(thiophene-2-carbonyl)-4,5-dihydro-1H-pyrazole
| Molecular Formula | C24H24N2O5S |
|---|---|
| Molecular Weight | 452.14 g/mol |
| LogP | 4.774 |
| Topological Polar Surface Area | 69.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.1406 |
| Heavy Atoms | 32 |
| Complexity | 1143.2963 |
Chemical Identifiers
| CAS Number | 402950-87-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN(C(C2)C3=C(C(=CC=C3)OC)OC)C(=O)C4=CC=CS4)OC |
Product Overview
ChemDiv1_008768 (CAS 402950-87-2), with molecular formula C24H24N2O5S and molecular weight 452.14 g/mol. IUPAC: [3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of ChemDiv1_008768
Property Insights of ChemDiv1_008768
The XLogP value of 4.774 indicates that ChemDiv1_008768 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.59 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_008768. Following Lipinski's Rule of Five, ChemDiv1_008768 has 0 hydrogen bond donor(s) and 7 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 ChemDiv1_008768?
The CAS number of ChemDiv1_008768 is 402950-87-2.
What is the molecular formula of ChemDiv1_008768?
The molecular formula of ChemDiv1_008768 is C24H24N2O5S.
What is the molecular weight of ChemDiv1_008768?
The molecular weight of ChemDiv1_008768 is 452.14 g/mol.
Where can I buy ChemDiv1_008768?
You can request a quote for ChemDiv1_008768 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008768?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008768 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.