BAS 02859599
TL;DR: BAS 02859599 (CAS 333424-77-4) is a chemical compound with molecular formula C20H18N4O3 and molecular weight 362.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[1-[2-(furan-2-ylmethylamino)-2-oxoethyl]indol-3-yl]-N-methylprop-2-enamide
Also Known As: BAS 02859599, AB00611011-06, (2E)-2-cyano-3-(1-{[N-(2-furylmethyl)carbamoyl]methyl}indol-3-yl)-N-methylprop -2-enamide, (2E)-2-cyano-3-(1-{2-[(furan-2-ylmethyl)amino]-2-oxoethyl}-1H-indol-3-yl)-N-methylprop-2-enamide, (E)-2-cyano-3-(1-(2-((furan-2-ylmethyl)amino)-2-oxoethyl)-1H-indol-3-yl)-N-methylacrylamide
| Molecular Formula | C20H18N4O3 |
|---|---|
| Molecular Weight | 362.14 g/mol |
| LogP | 2.20368 |
| Topological Polar Surface Area | 100.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.13788 |
| Heavy Atoms | 27 |
| Complexity | 1039.0514 |
Chemical Identifiers
| CAS Number | 333424-77-4 |
|---|---|
| SMILES | CNC(=O)/C(=C/C1=CN(C2=CC=CC=C21)CC(=O)NCC3=CC=CO3)/C#N |
Product Overview
BAS 02859599 (CAS 333424-77-4), with molecular formula C20H18N4O3 and molecular weight 362.14 g/mol. IUPAC: (E)-2-cyano-3-[1-[2-(furan-2-ylmethylamino)-2-oxoethyl]indol-3-yl]-N-methylprop-2-enamide.
Chemical Property Profile of BAS 02859599
Property Insights of BAS 02859599
The XLogP value of 2.20368 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02859599. The TPSA of 100.06 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02859599. Following Lipinski's Rule of Five, BAS 02859599 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 BAS 02859599?
The CAS number of BAS 02859599 is 333424-77-4.
What is the molecular formula of BAS 02859599?
The molecular formula of BAS 02859599 is C20H18N4O3.
What is the molecular weight of BAS 02859599?
The molecular weight of BAS 02859599 is 362.14 g/mol.
Where can I buy BAS 02859599?
You can request a quote for BAS 02859599 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02859599?
Yes, KEHONG BIO provides custom synthesis services for BAS 02859599 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.