ChemDiv1_005001
TL;DR: ChemDiv1_005001 (CAS 396723-03-8) is a chemical compound with molecular formula C20H19N5O5S2 and molecular weight 473.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(dimethylsulfamoyl)-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: ChemDiv1_005001, F0778-0309, 4-(dimethylsulfamoyl)-N-[2-(4-nitrophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]benzamide, 4-(N,N-dimethylsulfamoyl)-N-(2-(4-nitrophenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, 4-(dimethylsulfamoyl)-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
| Molecular Formula | C20H19N5O5S2 |
|---|---|
| Molecular Weight | 473.08 g/mol |
| LogP | 3.0299 |
| Topological Polar Surface Area | 127.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 473.08276 |
| Heavy Atoms | 32 |
| Complexity | 1299.3984 |
Chemical Identifiers
| CAS Number | 396723-03-8 |
|---|---|
| SMILES | CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C3CSCC3=NN2C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
ChemDiv1_005001 (CAS 396723-03-8), with molecular formula C20H19N5O5S2 and molecular weight 473.08 g/mol. IUPAC: 4-(dimethylsulfamoyl)-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide.
Chemical Property Profile of ChemDiv1_005001
Property Insights of ChemDiv1_005001
The XLogP value of 3.0299 indicates that ChemDiv1_005001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.44 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005001. Following Lipinski's Rule of Five, ChemDiv1_005001 has 1 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_005001?
The CAS number of ChemDiv1_005001 is 396723-03-8.
What is the molecular formula of ChemDiv1_005001?
The molecular formula of ChemDiv1_005001 is C20H19N5O5S2.
What is the molecular weight of ChemDiv1_005001?
The molecular weight of ChemDiv1_005001 is 473.08 g/mol.
Where can I buy ChemDiv1_005001?
You can request a quote for ChemDiv1_005001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005001?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.