ChemDiv1_014620
TL;DR: ChemDiv1_014620 (CAS 449786-60-1) is a chemical compound with molecular formula C21H22N4O5S2 and molecular weight 474.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(dimethylsulfamoyl)-N-[2-(2-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: ChemDiv1_014620, F0541-0290, 4-(dimethylsulfamoyl)-N-[2-(2-methylphenyl)-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl]benzamide, 4-(dimethylsulfamoyl)-N-[2-(2-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide, 4-(N,N-dimethylsulfamoyl)-N-(5,5-dioxido-2-(o-tolyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide
| Molecular Formula | C21H22N4O5S2 |
|---|---|
| Molecular Weight | 474.10 g/mol |
| LogP | 2.11172 |
| Topological Polar Surface Area | 118.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.10315 |
| Heavy Atoms | 32 |
| Complexity | 1423.3181 |
Chemical Identifiers
| CAS Number | 449786-60-1 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=C3CS(=O)(=O)CC3=N2)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N(C)C |
Product Overview
ChemDiv1_014620 (CAS 449786-60-1), with molecular formula C21H22N4O5S2 and molecular weight 474.10 g/mol. IUPAC: 4-(dimethylsulfamoyl)-N-[2-(2-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide.
Chemical Property Profile of ChemDiv1_014620
Property Insights of ChemDiv1_014620
The XLogP value of 2.11172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_014620. The TPSA of 118.44 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014620. Following Lipinski's Rule of Five, ChemDiv1_014620 has 1 hydrogen bond donor(s) and 6 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_014620?
The CAS number of ChemDiv1_014620 is 449786-60-1.
What is the molecular formula of ChemDiv1_014620?
The molecular formula of ChemDiv1_014620 is C21H22N4O5S2.
What is the molecular weight of ChemDiv1_014620?
The molecular weight of ChemDiv1_014620 is 474.10 g/mol.
Where can I buy ChemDiv1_014620?
You can request a quote for ChemDiv1_014620 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014620?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014620 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.