A1120/0052532
TL;DR: A1120/0052532 (CAS 296770-88-2) is a chemical compound with molecular formula C26H27N3O and molecular weight 397.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8E)-2-amino-6-ethyl-4-(2-methylphenyl)-8-[(2-methylphenyl)methylidene]-5,7-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Also Known As: A1120/0052532, (8E)-2-amino-6-ethyl-4-(2-methylphenyl)-8-[(2-methylphenyl)methylidene]-5,7-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile, (8E)-2-amino-6-ethyl-8-(2-methylbenzylidene)-4-(2-methylphenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile, (E)-2-amino-6-ethyl-8-(2-methylbenzylidene)-4-(o-tolyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile, 2-amino-6-ethyl-4-(2-methylphenyl)-8-[(2-methylphenyl)methylene]-5,6,7-trihydr o-4H-pyrano[3,2-c]pyridine-3-carbonitrile
| Molecular Formula | C26H27N3O |
|---|---|
| Molecular Weight | 397.22 g/mol |
| LogP | 4.78432 |
| Topological Polar Surface Area | 62.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 397.21542 |
| Heavy Atoms | 30 |
| Complexity | 1117.0938 |
Chemical Identifiers
| CAS Number | 296770-88-2 |
|---|---|
| SMILES | CCN1C/C(=C\C2=CC=CC=C2C)/C3=C(C1)C(C(=C(O3)N)C#N)C4=CC=CC=C4C |
Product Overview
A1120/0052532 (CAS 296770-88-2), with molecular formula C26H27N3O and molecular weight 397.22 g/mol. IUPAC: (8E)-2-amino-6-ethyl-4-(2-methylphenyl)-8-[(2-methylphenyl)methylidene]-5,7-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile.
Chemical Property Profile of A1120/0052532
Property Insights of A1120/0052532
The XLogP value of 4.78432 indicates that A1120/0052532 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.28 Ų falls within the moderate polarity range, balancing permeability and solubility for A1120/0052532. Following Lipinski's Rule of Five, A1120/0052532 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 A1120/0052532?
The CAS number of A1120/0052532 is 296770-88-2.
What is the molecular formula of A1120/0052532?
The molecular formula of A1120/0052532 is C26H27N3O.
What is the molecular weight of A1120/0052532?
The molecular weight of A1120/0052532 is 397.22 g/mol.
Where can I buy A1120/0052532?
You can request a quote for A1120/0052532 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1120/0052532?
Yes, KEHONG BIO provides custom synthesis services for A1120/0052532 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.