F1016-0587
TL;DR: F1016-0587 (CAS 403837-34-3) is a chemical compound with molecular formula C24H28N2O6S and molecular weight 472.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[2-[3-(2,3-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanylpropanoate
Also Known As: F1016-0587, methyl 3-({2-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)propanoate, methyl 3-({2-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}thio)propanoate, methyl 3-[2-[3-(2,3-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanylpropanoate, methyl 3-((2-(5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)-2-oxoethyl)thio)propanoate
| Molecular Formula | C24H28N2O6S |
|---|---|
| Molecular Weight | 472.17 g/mol |
| LogP | 3.6864 |
| Topological Polar Surface Area | 86.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 472.1668 |
| Heavy Atoms | 33 |
| Complexity | 1008.5141 |
Chemical Identifiers
| CAS Number | 403837-34-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN(C(C2)C3=C(C(=CC=C3)OC)OC)C(=O)CSCCC(=O)OC |
Product Overview
F1016-0587 (CAS 403837-34-3), with molecular formula C24H28N2O6S and molecular weight 472.17 g/mol. IUPAC: methyl 3-[2-[3-(2,3-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanylpropanoate.
Chemical Property Profile of F1016-0587
Property Insights of F1016-0587
The XLogP value of 3.6864 indicates that F1016-0587 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 F1016-0587. Following Lipinski's Rule of Five, F1016-0587 has 0 hydrogen bond donor(s) and 8 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 F1016-0587?
The CAS number of F1016-0587 is 403837-34-3.
What is the molecular formula of F1016-0587?
The molecular formula of F1016-0587 is C24H28N2O6S.
What is the molecular weight of F1016-0587?
The molecular weight of F1016-0587 is 472.17 g/mol.
Where can I buy F1016-0587?
You can request a quote for F1016-0587 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1016-0587?
Yes, KEHONG BIO provides custom synthesis services for F1016-0587 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.