3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile
TL;DR: 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile (CAS 370075-23-3) is a chemical compound with molecular formula C18H12N2O2S and molecular weight 320.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-9-hydroxy-1-thiophen-3-yl-1H-benzo[f]chromene-2-carbonitrile
Also Known As: 3-Amino-9-hydroxy-1-thiophen-3-yl-1H-benzo[f]chromene-2-carbonitrile, 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile, 3-amino-9-hydroxy-1-thien-3-yl-1H-benzo[f]chromene-2-carbonitrile
| Molecular Formula | C18H12N2O2S |
|---|---|
| Molecular Weight | 320.06 g/mol |
| LogP | 3.82508 |
| Topological Polar Surface Area | 79.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 320.06195 |
| Heavy Atoms | 23 |
| Complexity | 984.1694 |
Chemical Identifiers
| CAS Number | 370075-23-3 |
|---|---|
| SMILES | C1=CC(=CC2=C1C=CC3=C2C(C(=C(O3)N)C#N)C4=CSC=C4)O |
Product Overview
3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile (CAS 370075-23-3), with molecular formula C18H12N2O2S and molecular weight 320.06 g/mol. IUPAC: 3-amino-9-hydroxy-1-thiophen-3-yl-1H-benzo[f]chromene-2-carbonitrile.
Chemical Property Profile of 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile
Property Insights of 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile
The XLogP value of 3.82508 indicates that 3-amino-9-hydroxy-1-(thiophen-3-yl)-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-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile. Following Lipinski's Rule of Five, 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile has 2 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 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile?
The CAS number of 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile is 370075-23-3.
What is the molecular formula of 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile?
The molecular formula of 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile is C18H12N2O2S.
What is the molecular weight of 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile?
The molecular weight of 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile is 320.06 g/mol.
Where can I buy 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile?
You can request a quote for 3-amino-9-hydroxy-1-(thiophen-3-yl)-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-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-amino-9-hydroxy-1-(thiophen-3-yl)-1H-benzo[f]chromene-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.