ChemDiv3_012327
TL;DR: ChemDiv3_012327 (CAS 878057-19-3) is a chemical compound with molecular formula C23H26FN3O4S and molecular weight 459.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-[3-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]sulfonylindol-1-yl]acetamide
Also Known As: ChemDiv3_012327, BRD-K79955364-001-01-4, N,N-diethyl-2-[3-({[(4-fluorophenyl)methyl]carbamoyl}methanesulfonyl)-1H-indol-1-yl]acetamide, N,N-diethyl-2-(3-((2-((4-fluorobenzyl)amino)-2-oxoethyl)sulfonyl)-1H-indol-1-yl)acetamide, N,N-diethyl-2-[3-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]sulfonylindol-1-yl]acetamide
| Molecular Formula | C23H26FN3O4S |
|---|---|
| Molecular Weight | 459.16 g/mol |
| LogP | 2.7389 |
| Topological Polar Surface Area | 88.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 459.1628 |
| Heavy Atoms | 32 |
| Complexity | 1215.7723 |
Chemical Identifiers
| CAS Number | 878057-19-3 |
|---|---|
| SMILES | CCN(CC)C(=O)CN1C=C(C2=CC=CC=C21)S(=O)(=O)CC(=O)NCC3=CC=C(C=C3)F |
Product Overview
ChemDiv3_012327 (CAS 878057-19-3), with molecular formula C23H26FN3O4S and molecular weight 459.16 g/mol. IUPAC: N,N-diethyl-2-[3-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]sulfonylindol-1-yl]acetamide.
Chemical Property Profile of ChemDiv3_012327
Property Insights of ChemDiv3_012327
The XLogP value of 2.7389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_012327. The TPSA of 88.48 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_012327. Following Lipinski's Rule of Five, ChemDiv3_012327 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_012327?
The CAS number of ChemDiv3_012327 is 878057-19-3.
What is the molecular formula of ChemDiv3_012327?
The molecular formula of ChemDiv3_012327 is C23H26FN3O4S.
What is the molecular weight of ChemDiv3_012327?
The molecular weight of ChemDiv3_012327 is 459.16 g/mol.
Where can I buy ChemDiv3_012327?
You can request a quote for ChemDiv3_012327 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_012327?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_012327 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.