地尔硫卓
TL;DR: 地尔硫卓 (CAS 34933-06-7) is a chemical compound with molecular formula C22H26N2O4S and molecular weight 414.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
地尔硫卓
[5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate
Also Known As: diltiazem, Dilacor XR, Bosutinib, Cardizem, Diltiazem-d6
| Molecular Formula | C22H26N2O4S |
|---|---|
| Molecular Weight | 414.16 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 84.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 414.16132 |
| Heavy Atoms | 29 |
| Complexity | 565.0 |
Chemical Identifiers
| CAS Number | 34933-06-7 |
|---|---|
| SMILES | CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC |
| InChIKey | HSUGRBWQSSZJOP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
地尔硫卓 (CAS 34933-06-7), with molecular formula C22H26N2O4S and molecular weight 414.16 g/mol. IUPAC: [5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate.
Chemical Property Profile of 地尔硫卓
Property Insights of 地尔硫卓
The XLogP value of 3.1 indicates that diltiazem is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 地尔硫卓. Following Lipinski's Rule of Five, diltiazem has 0 hydrogen bond donor(s) and 6 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 diltiazem?
The CAS number of diltiazem is 34933-06-7.
What is the molecular formula of diltiazem?
The molecular formula of diltiazem is C22H26N2O4S.
What is the molecular weight of diltiazem?
The molecular weight of diltiazem is 414.16 g/mol.
Where can I buy diltiazem?
You can request a quote for diltiazem directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diltiazem?
Yes, KEHONG BIO provides custom synthesis services for diltiazem and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.