Cromakalim
TL;DR: Cromakalim (CAS 94535-51-0) is a chemical compound with molecular formula C16H18N2O3 and molecular weight 286.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2,2-dimethyl-4-(2-oxopyrrolidin-1-yl)-3,4-dihydrochromene-6-carbonitrile
Also Known As: Cromakalim, Levcromakalim, (+/-)-cromakalim, Cromakalime, Cromakalimum
| Molecular Formula | C16H18N2O3 |
|---|---|
| Molecular Weight | 286.13 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 73.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 286.13174 |
| Heavy Atoms | 21 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 94535-51-0 |
|---|---|
| SMILES | CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CCCC3=O)O)C |
| InChIKey | TVZCRIROJQEVOT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cromakalim (CAS 94535-51-0), with molecular formula C16H18N2O3 and molecular weight 286.13 g/mol. IUPAC: 3-hydroxy-2,2-dimethyl-4-(2-oxopyrrolidin-1-yl)-3,4-dihydrochromene-6-carbonitrile.
Chemical Property Profile of Cromakalim
Property Insights of Cromakalim
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cromakalim. The TPSA of 73.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Cromakalim. Following Lipinski's Rule of Five, Cromakalim 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 Cromakalim?
The CAS number of Cromakalim is 94535-51-0.
What is the molecular formula of Cromakalim?
The molecular formula of Cromakalim is C16H18N2O3.
What is the molecular weight of Cromakalim?
The molecular weight of Cromakalim is 286.13 g/mol.
Where can I buy Cromakalim?
You can request a quote for Cromakalim directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cromakalim?
Yes, KEHONG BIO provides custom synthesis services for Cromakalim and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.