ChemDiv3_009101
TL;DR: ChemDiv3_009101 (CAS 851718-39-3) is a chemical compound with molecular formula C20H23N3O3S and molecular weight 385.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[2-(2-methylpropanoyl)-3-phenyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide
Also Known As: ChemDiv3_009101, IDI1_027011, BRD-A44997499-001-01-8, F0621-0229, N-(4-(1-isobutyryl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phenyl)methanesulfonamide
| Molecular Formula | C20H23N3O3S |
|---|---|
| Molecular Weight | 385.15 g/mol |
| LogP | 3.3918 |
| Topological Polar Surface Area | 78.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.14603 |
| Heavy Atoms | 27 |
| Complexity | 951.72626 |
Chemical Identifiers
| CAS Number | 851718-39-3 |
|---|---|
| SMILES | CC(C)C(=O)N1C(CC(=N1)C2=CC=C(C=C2)NS(=O)(=O)C)C3=CC=CC=C3 |
Product Overview
ChemDiv3_009101 (CAS 851718-39-3), with molecular formula C20H23N3O3S and molecular weight 385.15 g/mol. IUPAC: N-[4-[2-(2-methylpropanoyl)-3-phenyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide.
Chemical Property Profile of ChemDiv3_009101
Property Insights of ChemDiv3_009101
The XLogP value of 3.3918 indicates that ChemDiv3_009101 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.84 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_009101. Following Lipinski's Rule of Five, ChemDiv3_009101 has 1 hydrogen bond donor(s) and 4 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 ChemDiv3_009101?
The CAS number of ChemDiv3_009101 is 851718-39-3.
What is the molecular formula of ChemDiv3_009101?
The molecular formula of ChemDiv3_009101 is C20H23N3O3S.
What is the molecular weight of ChemDiv3_009101?
The molecular weight of ChemDiv3_009101 is 385.15 g/mol.
Where can I buy ChemDiv3_009101?
You can request a quote for ChemDiv3_009101 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_009101?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_009101 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.