A3739/0158427
TL;DR: A3739/0158427 (CAS 727665-99-8) is a chemical compound with molecular formula C27H28N4O4 and molecular weight 472.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide
Also Known As: A3739/0158427, (2Z)-N-[2-(1H-13-BENZODIAZOL-2-YL)ETHYL]-3-(FURAN-2-YL)-2-{[4-(2-METHYLPROPOXY)PHENYL]FORMAMIDO}PROP-2-ENAMIDE, (Z)-N-(3-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide, N-[(1Z)-3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide, N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide
| Molecular Formula | C27H28N4O4 |
|---|---|
| Molecular Weight | 472.21 g/mol |
| LogP | 4.3205 |
| Topological Polar Surface Area | 109.25 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 472.21106 |
| Heavy Atoms | 35 |
| Complexity | 1271.7279 |
Chemical Identifiers
| CAS Number | 727665-99-8 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=CO2)/C(=O)NCCC3=NC4=CC=CC=C4N3 |
Product Overview
A3739/0158427 (CAS 727665-99-8), with molecular formula C27H28N4O4 and molecular weight 472.21 g/mol. IUPAC: N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide.
Chemical Property Profile of A3739/0158427
Property Insights of A3739/0158427
The XLogP value of 4.3205 indicates that A3739/0158427 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.25 Ų falls within the moderate polarity range, balancing permeability and solubility for A3739/0158427. Following Lipinski's Rule of Five, A3739/0158427 has 3 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 A3739/0158427?
The CAS number of A3739/0158427 is 727665-99-8.
What is the molecular formula of A3739/0158427?
The molecular formula of A3739/0158427 is C27H28N4O4.
What is the molecular weight of A3739/0158427?
The molecular weight of A3739/0158427 is 472.21 g/mol.
Where can I buy A3739/0158427?
You can request a quote for A3739/0158427 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3739/0158427?
Yes, KEHONG BIO provides custom synthesis services for A3739/0158427 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.