C25H19ClN4O3
TL;DR: C25H19ClN4O3 (CAS 333424-90-1) is a chemical compound with molecular formula C25H19ClN4O3 and molecular weight 458.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(4-chlorophenyl)-2-cyano-3-[1-[2-(furan-2-ylmethylamino)-2-oxoethyl]indol-3-yl]prop-2-enamide
Also Known As: BAS 02859612, (2E)-N-(4-chlorophenyl)-2-cyano-3-(1-{[N-(2-furylmethyl)carbamoyl]methyl}indol -3-yl)prop-2-enamide, (2E)-N-(4-chlorophenyl)-2-cyano-3-(1-{2-[(furan-2-ylmethyl)amino]-2-oxoethyl}-1H-indol-3-yl)prop-2-enamide, (E)-N-(4-chlorophenyl)-2-cyano-3-(1-(2-((furan-2-ylmethyl)amino)-2-oxoethyl)-1H-indol-3-yl)acrylamide
| Molecular Formula | C25H19ClN4O3 |
|---|---|
| Molecular Weight | 458.11 g/mol |
| LogP | 4.74978 |
| Topological Polar Surface Area | 100.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 458.11456 |
| Heavy Atoms | 33 |
| Complexity | 1363.175 |
Chemical Identifiers
| CAS Number | 333424-90-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2CC(=O)NCC3=CC=CO3)/C=C(\C#N)/C(=O)NC4=CC=C(C=C4)Cl |
Product Overview
C25H19ClN4O3 (CAS 333424-90-1), with molecular formula C25H19ClN4O3 and molecular weight 458.11 g/mol. IUPAC: (E)-N-(4-chlorophenyl)-2-cyano-3-[1-[2-(furan-2-ylmethylamino)-2-oxoethyl]indol-3-yl]prop-2-enamide.
Chemical Property Profile of C25H19ClN4O3
Property Insights of C25H19ClN4O3
The XLogP value of 4.74978 indicates that C25H19ClN4O3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.06 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H19ClN4O3. Following Lipinski's Rule of Five, C25H19ClN4O3 has 2 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 C25H19ClN4O3?
The CAS number of C25H19ClN4O3 is 333424-90-1.
What is the molecular formula of C25H19ClN4O3?
The molecular formula of C25H19ClN4O3 is C25H19ClN4O3.
What is the molecular weight of C25H19ClN4O3?
The molecular weight of C25H19ClN4O3 is 458.11 g/mol.
Where can I buy C25H19ClN4O3?
You can request a quote for C25H19ClN4O3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H19ClN4O3?
Yes, KEHONG BIO provides custom synthesis services for C25H19ClN4O3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.