terconazole
TL;DR: terconazole (CAS 67915-31-5) is a chemical compound with molecular formula C26H31Cl2N5O3 and molecular weight 531.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[[2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-4-propan-2-ylpiperazine
Also Known As: terconazole, Triaconazole, termayazole, Terconazol, Fungistat
| Molecular Formula | C26H31Cl2N5O3 |
|---|---|
| Molecular Weight | 531.18 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 531.1804 |
| Heavy Atoms | 36 |
| Complexity | 692.0 |
Chemical Identifiers
| CAS Number | 67915-31-5 |
|---|---|
| SMILES | CC(C)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=NC=N4)C5=C(C=C(C=C5)Cl)Cl |
| InChIKey | BLSQLHNBWJLIBQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
terconazole (CAS 67915-31-5), with molecular formula C26H31Cl2N5O3 and molecular weight 531.18 g/mol. IUPAC: 1-[4-[[2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-4-propan-2-ylpiperazine.
Chemical Property Profile of terconazole
Property Insights of terconazole
The XLogP value of 4.8 indicates that terconazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for terconazole. Following Lipinski's Rule of Five, terconazole has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of terconazole?
The CAS number of terconazole is 67915-31-5.
What is the molecular formula of terconazole?
The molecular formula of terconazole is C26H31Cl2N5O3.
What is the molecular weight of terconazole?
The molecular weight of terconazole is 531.18 g/mol.
Where can I buy terconazole?
You can request a quote for terconazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for terconazole?
Yes, KEHONG BIO provides custom synthesis services for terconazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.