3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile
TL;DR: 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile (CAS 311762-98-8) is a chemical compound with molecular formula C20H14N2O2 and molecular weight 314.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile
Also Known As: 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile, J1.742.436J, A1330/0060155, 9-Hydroxy-3-amino-1-phenyl-1H-naphtho[2,1-b]pyran-2-carbonitrile
| Molecular Formula | C20H14N2O2 |
|---|---|
| Molecular Weight | 314.11 g/mol |
| LogP | 3.76358 |
| Topological Polar Surface Area | 79.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.10553 |
| Heavy Atoms | 24 |
| Complexity | 1016.98346 |
Chemical Identifiers
| CAS Number | 311762-98-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(=C(OC3=C2C4=C(C=CC(=C4)O)C=C3)N)C#N |
Product Overview
3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile (CAS 311762-98-8), with molecular formula C20H14N2O2 and molecular weight 314.11 g/mol. IUPAC: 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile.
Chemical Property Profile of 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile
Property Insights of 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile
The XLogP value of 3.76358 indicates that 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile. Following Lipinski's Rule of Five, 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile 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 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile?
The CAS number of 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile is 311762-98-8.
What is the molecular formula of 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile?
The molecular formula of 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile is C20H14N2O2.
What is the molecular weight of 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile?
The molecular weight of 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile is 314.11 g/mol.
Where can I buy 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile?
You can request a quote for 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-amino-9-hydroxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.