ChemDiv1_014492
TL;DR: ChemDiv1_014492 (CAS 449791-49-5) is a chemical compound with molecular formula C24H26ClN3O6S and molecular weight 519.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-chlorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxybenzamide
Also Known As: ChemDiv1_014492, F0541-0556, N-[2-(4-chlorophenyl)-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxybenzamide, N-[2-(4-chlorophenyl)-5,5-dioxido-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxybenzamide, N-[2-(4-chlorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxybenzamide
| Molecular Formula | C24H26ClN3O6S |
|---|---|
| Molecular Weight | 519.12 g/mol |
| LogP | 4.4025 |
| Topological Polar Surface Area | 108.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 519.1231 |
| Heavy Atoms | 35 |
| Complexity | 1325.3193 |
Chemical Identifiers
| CAS Number | 449791-49-5 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C3CS(=O)(=O)CC3=NN2C4=CC=C(C=C4)Cl |
Product Overview
ChemDiv1_014492 (CAS 449791-49-5), with molecular formula C24H26ClN3O6S and molecular weight 519.12 g/mol. IUPAC: N-[2-(4-chlorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxybenzamide.
Chemical Property Profile of ChemDiv1_014492
Property Insights of ChemDiv1_014492
The XLogP value of 4.4025 indicates that ChemDiv1_014492 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.75 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014492. Following Lipinski's Rule of Five, ChemDiv1_014492 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_014492?
The CAS number of ChemDiv1_014492 is 449791-49-5.
What is the molecular formula of ChemDiv1_014492?
The molecular formula of ChemDiv1_014492 is C24H26ClN3O6S.
What is the molecular weight of ChemDiv1_014492?
The molecular weight of ChemDiv1_014492 is 519.12 g/mol.
Where can I buy ChemDiv1_014492?
You can request a quote for ChemDiv1_014492 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014492?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014492 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.