ChemDiv3_004107
TL;DR: ChemDiv3_004107 (CAS 489403-97-6) is a chemical compound with molecular formula C18H20N2O4S and molecular weight 360.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxyphenyl)-5-(4-methoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
Also Known As: ChemDiv3_004107, IDI1_022017, 5-(2-methoxyphenyl)-3-(4-methoxyphenyl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazole, BRD-A46474565-001-01-5, F1138-0032
| Molecular Formula | C18H20N2O4S |
|---|---|
| Molecular Weight | 360.11 g/mol |
| LogP | 2.8145 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.11438 |
| Heavy Atoms | 25 |
| Complexity | 891.547 |
Chemical Identifiers
| CAS Number | 489403-97-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3OC)S(=O)(=O)C |
Product Overview
ChemDiv3_004107 (CAS 489403-97-6), with molecular formula C18H20N2O4S and molecular weight 360.11 g/mol. IUPAC: 3-(2-methoxyphenyl)-5-(4-methoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole.
Chemical Property Profile of ChemDiv3_004107
Property Insights of ChemDiv3_004107
The XLogP value of 2.8145 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_004107. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_004107. Following Lipinski's Rule of Five, ChemDiv3_004107 has 0 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 ChemDiv3_004107?
The CAS number of ChemDiv3_004107 is 489403-97-6.
What is the molecular formula of ChemDiv3_004107?
The molecular formula of ChemDiv3_004107 is C18H20N2O4S.
What is the molecular weight of ChemDiv3_004107?
The molecular weight of ChemDiv3_004107 is 360.11 g/mol.
Where can I buy ChemDiv3_004107?
You can request a quote for ChemDiv3_004107 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_004107?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_004107 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.