ChemDiv1_007916
TL;DR: ChemDiv1_007916 (CAS 402947-94-8) is a chemical compound with molecular formula C25H26N2O6S and molecular weight 482.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonyl)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-3,4-dihydropyrazole
Also Known As: ChemDiv1_007916, F0877-0057, 1-(benzenesulfonyl)-5-(2,3-dimethoxyphenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole, 2-(benzenesulfonyl)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-3,4-dihydropyrazole, 5-(2,3-dimethoxyphenyl)-3-(3,4-dimethoxyphenyl)-1-(phenylsulfonyl)-4,5-dihydro-1H-pyrazole
| Molecular Formula | C25H26N2O6S |
|---|---|
| Molecular Weight | 482.15 g/mol |
| LogP | 4.261 |
| Topological Polar Surface Area | 86.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 482.15115 |
| Heavy Atoms | 34 |
| Complexity | 1308.2361 |
Chemical Identifiers
| CAS Number | 402947-94-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN(C(C2)C3=C(C(=CC=C3)OC)OC)S(=O)(=O)C4=CC=CC=C4)OC |
Product Overview
ChemDiv1_007916 (CAS 402947-94-8), with molecular formula C25H26N2O6S and molecular weight 482.15 g/mol. IUPAC: 2-(benzenesulfonyl)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-3,4-dihydropyrazole.
Chemical Property Profile of ChemDiv1_007916
Property Insights of ChemDiv1_007916
The XLogP value of 4.261 indicates that ChemDiv1_007916 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.66 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_007916. Following Lipinski's Rule of Five, ChemDiv1_007916 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_007916?
The CAS number of ChemDiv1_007916 is 402947-94-8.
What is the molecular formula of ChemDiv1_007916?
The molecular formula of ChemDiv1_007916 is C25H26N2O6S.
What is the molecular weight of ChemDiv1_007916?
The molecular weight of ChemDiv1_007916 is 482.15 g/mol.
Where can I buy ChemDiv1_007916?
You can request a quote for ChemDiv1_007916 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_007916?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_007916 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.