(4-Chlorophenyl)(1-isoquinolinyl)methanol
TL;DR: (4-Chlorophenyl)(1-isoquinolinyl)methanol (CAS 31101-09-4) is a chemical compound with molecular formula C16H12ClNO and molecular weight 269.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-isoquinolin-1-ylmethanol
Also Known As: (4-chlorophenyl)(1-isoquinolinyl)methanol, (4-chlorophenyl)-isoquinolin-1-ylmethanol, (4-chlorophenyl)(isoquinolin-1-yl)methanol, AQ-405/10984003
| Molecular Formula | C16H12ClNO |
|---|---|
| Molecular Weight | 269.06 g/mol |
| LogP | 3.9699 |
| Topological Polar Surface Area | 33.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.06073 |
| Heavy Atoms | 19 |
| Complexity | 704.02563 |
Chemical Identifiers
| CAS Number | 31101-09-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CN=C2C(C3=CC=C(C=C3)Cl)O |
Product Overview
(4-Chlorophenyl)(1-isoquinolinyl)methanol (CAS 31101-09-4), with molecular formula C16H12ClNO and molecular weight 269.06 g/mol. IUPAC: (4-chlorophenyl)-isoquinolin-1-ylmethanol.
Chemical Property Profile of (4-Chlorophenyl)(1-isoquinolinyl)methanol
Property Insights of (4-Chlorophenyl)(1-isoquinolinyl)methanol
The XLogP value of 3.9699 indicates that (4-Chlorophenyl)(1-isoquinolinyl)methanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.12 Ų, (4-Chlorophenyl)(1-isoquinolinyl)methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Chlorophenyl)(1-isoquinolinyl)methanol has 1 hydrogen bond donor(s) and 2 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 (4-Chlorophenyl)(1-isoquinolinyl)methanol?
The CAS number of (4-Chlorophenyl)(1-isoquinolinyl)methanol is 31101-09-4.
What is the molecular formula of (4-Chlorophenyl)(1-isoquinolinyl)methanol?
The molecular formula of (4-Chlorophenyl)(1-isoquinolinyl)methanol is C16H12ClNO.
What is the molecular weight of (4-Chlorophenyl)(1-isoquinolinyl)methanol?
The molecular weight of (4-Chlorophenyl)(1-isoquinolinyl)methanol is 269.06 g/mol.
Where can I buy (4-Chlorophenyl)(1-isoquinolinyl)methanol?
You can request a quote for (4-Chlorophenyl)(1-isoquinolinyl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Chlorophenyl)(1-isoquinolinyl)methanol?
Yes, KEHONG BIO provides custom synthesis services for (4-Chlorophenyl)(1-isoquinolinyl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.