Clentiazem Maleate
TL;DR: Clentiazem Maleate (CAS 96128-92-6) is a chemical compound with molecular formula C26H29ClN2O8S and molecular weight 564.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-but-2-enedioic acid;[(2S,3S)-8-chloro-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate
Also Known As: CLENTIAZEM MALEATE, Logna, Clentiazem maleate [USAN], (S,S)-Clentiazem maleate, CLENTIAZEM MALEATE [MI]
| Molecular Formula | C26H29ClN2O8S |
|---|---|
| Molecular Weight | 564.13 g/mol |
| LogP | 3.7337 |
| Topological Polar Surface Area | 133.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 564.1333 |
| Heavy Atoms | 38 |
| Complexity | 1170.2706 |
Chemical Identifiers
| CAS Number | 96128-92-6 |
|---|---|
| SMILES | CC(=O)O[C@@H]1[C@@H](SC2=C(C=CC(=C2)Cl)N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC.C(=C\C(=O)O)\C(=O)O |
Product Overview
Clentiazem Maleate (CAS 96128-92-6), with molecular formula C26H29ClN2O8S and molecular weight 564.13 g/mol. IUPAC: (Z)-but-2-enedioic acid;[(2S,3S)-8-chloro-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate.
Chemical Property Profile of Clentiazem Maleate
Property Insights of Clentiazem Maleate
The XLogP value of 3.7337 indicates that Clentiazem Maleate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Clentiazem Maleate. Following Lipinski's Rule of Five, Clentiazem Maleate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Clentiazem Maleate?
The CAS number of Clentiazem Maleate is 96128-92-6.
What is the molecular formula of Clentiazem Maleate?
The molecular formula of Clentiazem Maleate is C26H29ClN2O8S.
What is the molecular weight of Clentiazem Maleate?
The molecular weight of Clentiazem Maleate is 564.13 g/mol.
Where can I buy Clentiazem Maleate?
You can request a quote for Clentiazem Maleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clentiazem Maleate?
Yes, KEHONG BIO provides custom synthesis services for Clentiazem Maleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.