Cariporide
TL;DR: Cariporide (CAS 159138-73-5) is a chemical compound with molecular formula C12H17N3O3S and molecular weight 283.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(diaminomethylidene)-3-methylsulfonyl-4-propan-2-ylbenzamide
Also Known As: Cariporide, Cariporida, Cariporide [INN], cariporidum, PBCMRIPORIDE
| Molecular Formula | C12H17N3O3S |
|---|---|
| Molecular Weight | 283.10 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.09906 |
| Heavy Atoms | 19 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 159138-73-5 |
|---|---|
| SMILES | CC(C)C1=C(C=C(C=C1)C(=O)N=C(N)N)S(=O)(=O)C |
| InChIKey | IWXNYAIICFKCTM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cariporide (CAS 159138-73-5), with molecular formula C12H17N3O3S and molecular weight 283.10 g/mol. IUPAC: N-(diaminomethylidene)-3-methylsulfonyl-4-propan-2-ylbenzamide.
Chemical Property Profile of Cariporide
Property Insights of Cariporide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cariporide. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cariporide. Following Lipinski's Rule of Five, Cariporide has 2 hydrogen bond donor(s) and 3 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 Cariporide?
The CAS number of Cariporide is 159138-73-5.
What is the molecular formula of Cariporide?
The molecular formula of Cariporide is C12H17N3O3S.
What is the molecular weight of Cariporide?
The molecular weight of Cariporide is 283.10 g/mol.
Where can I buy Cariporide?
You can request a quote for Cariporide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cariporide?
Yes, KEHONG BIO provides custom synthesis services for Cariporide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.