卡替洛尔
TL;DR: 卡替洛尔 (CAS 51781-06-7) is a chemical compound with molecular formula C16H24N2O3 and molecular weight 292.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
卡替洛尔
5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-1H-quinolin-2-one
Also Known As: CARTEOLOL, Carteololum, Carteolol HCl, Ocupress, Cartrol
| Molecular Formula | C16H24N2O3 |
|---|---|
| Molecular Weight | 292.18 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 70.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 292.17868 |
| Heavy Atoms | 21 |
| Complexity | 354.0 |
| Solubility | 4.21e-01 g/L |
Chemical Identifiers
| CAS Number | 51781-06-7 |
|---|---|
| SMILES | CC(C)(C)NCC(COC1=CC=CC2=C1CCC(=O)N2)O |
| InChIKey | LWAFSWPYPHEXKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
卡替洛尔 (CAS 51781-06-7), with molecular formula C16H24N2O3 and molecular weight 292.18 g/mol. IUPAC: 5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-1H-quinolin-2-one.
Chemical Property Profile of 卡替洛尔
Property Insights of 卡替洛尔
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 卡替洛尔. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 卡替洛尔. Following Lipinski's Rule of Five, 卡替洛尔 has 3 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 卡替洛尔?
The CAS number of 卡替洛尔 is 51781-06-7.
What is the molecular formula of 卡替洛尔?
The molecular formula of 卡替洛尔 is C16H24N2O3.
What is the molecular weight of 卡替洛尔?
The molecular weight of 卡替洛尔 is 292.18 g/mol.
Where can I buy 卡替洛尔?
You can request a quote for 卡替洛尔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 卡替洛尔?
Yes, KEHONG BIO provides custom synthesis services for 卡替洛尔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.