4-Hydroxymethyl Loratadine
TL;DR: 4-Hydroxymethyl Loratadine (CAS 609806-40-8) is a chemical compound with molecular formula C23H25ClN2O3 and molecular weight 412.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[13-chloro-7-(hydroxymethyl)-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-2-ylidene]piperidine-1-carboxylate
Also Known As: 4-Hydroxymethyl Loratadine, 4-Hydroxy Methyl Loratadine, Loratadine 4-Hydroxymethyl Impurity, Loratadine 4-Hydroxymethyl Impurity (USP), DISCONTINUED. Please see H949915
| Molecular Formula | C23H25ClN2O3 |
|---|---|
| Molecular Weight | 412.16 g/mol |
| LogP | 4.3801 |
| Topological Polar Surface Area | 62.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 412.15536 |
| Heavy Atoms | 29 |
| Complexity | 960.59045 |
Chemical Identifiers
| CAS Number | 609806-40-8 |
|---|---|
| SMILES | CCOC(=O)N1CCC(=C2C3=C(CCC4=C(C=CN=C42)CO)C=C(C=C3)Cl)CC1 |
Product Overview
4-Hydroxymethyl Loratadine (CAS 609806-40-8), with molecular formula C23H25ClN2O3 and molecular weight 412.16 g/mol. IUPAC: ethyl 4-[13-chloro-7-(hydroxymethyl)-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-2-ylidene]piperidine-1-carboxylate.
Chemical Property Profile of 4-Hydroxymethyl Loratadine
Property Insights of 4-Hydroxymethyl Loratadine
The XLogP value of 4.3801 indicates that 4-Hydroxymethyl Loratadine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxymethyl Loratadine. Following Lipinski's Rule of Five, 4-Hydroxymethyl Loratadine 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 4-Hydroxymethyl Loratadine?
The CAS number of 4-Hydroxymethyl Loratadine is 609806-40-8.
What is the molecular formula of 4-Hydroxymethyl Loratadine?
The molecular formula of 4-Hydroxymethyl Loratadine is C23H25ClN2O3.
What is the molecular weight of 4-Hydroxymethyl Loratadine?
The molecular weight of 4-Hydroxymethyl Loratadine is 412.16 g/mol.
Where can I buy 4-Hydroxymethyl Loratadine?
You can request a quote for 4-Hydroxymethyl Loratadine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxymethyl Loratadine?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxymethyl Loratadine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.