ChemDiv1_004777
TL;DR: ChemDiv1_004777 (CAS 392254-85-2) is a chemical compound with molecular formula C22H21ClN4O3S2 and molecular weight 488.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-chlorophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-pyrrolidin-1-ylsulfonylbenzamide
Also Known As: ChemDiv1_004777, F0396-0188, N-[2-(4-chlorophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]-4-(pyrrolidine-1-sulfonyl)benzamide, N-(2-(4-chlorophenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-4-(pyrrolidin-1-ylsulfonyl)benzamide, N-[2-(4-chlorophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-pyrrolidin-1-ylsulfonylbenzamide
| Molecular Formula | C22H21ClN4O3S2 |
|---|---|
| Molecular Weight | 488.07 g/mol |
| LogP | 4.3093 |
| Topological Polar Surface Area | 84.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 488.07437 |
| Heavy Atoms | 32 |
| Complexity | 1265.7548 |
Chemical Identifiers
| CAS Number | 392254-85-2 |
|---|---|
| SMILES | C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C4CSCC4=NN3C5=CC=C(C=C5)Cl |
Product Overview
ChemDiv1_004777 (CAS 392254-85-2), with molecular formula C22H21ClN4O3S2 and molecular weight 488.07 g/mol. IUPAC: N-[2-(4-chlorophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-pyrrolidin-1-ylsulfonylbenzamide.
Chemical Property Profile of ChemDiv1_004777
Property Insights of ChemDiv1_004777
The XLogP value of 4.3093 indicates that ChemDiv1_004777 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.3 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_004777. Following Lipinski's Rule of Five, ChemDiv1_004777 has 1 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 ChemDiv1_004777?
The CAS number of ChemDiv1_004777 is 392254-85-2.
What is the molecular formula of ChemDiv1_004777?
The molecular formula of ChemDiv1_004777 is C22H21ClN4O3S2.
What is the molecular weight of ChemDiv1_004777?
The molecular weight of ChemDiv1_004777 is 488.07 g/mol.
Where can I buy ChemDiv1_004777?
You can request a quote for ChemDiv1_004777 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_004777?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_004777 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.