Rilmakalim
TL;DR: Rilmakalim (CAS 132014-21-2) is a chemical compound with molecular formula C21H23NO5S and molecular weight 401.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3S,4R)-6-(benzenesulfonyl)-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-one
Also Known As: Rilmakalim, Rilmakalimum, rimalkalim, Rilmakalime, Rilmakalim [INN]
| Molecular Formula | C21H23NO5S |
|---|---|
| Molecular Weight | 401.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 401.1297 |
| Heavy Atoms | 28 |
| Complexity | 694.0 |
Chemical Identifiers
| CAS Number | 132014-21-2 |
|---|---|
| SMILES | CC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)N4CCCC4=O)O)C |
| InChIKey | LKAQWOWWTKFLNX-UXHICEINSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Rilmakalim (CAS 132014-21-2), with molecular formula C21H23NO5S and molecular weight 401.13 g/mol. IUPAC: 1-[(3S,4R)-6-(benzenesulfonyl)-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-one.
Chemical Property Profile of Rilmakalim
Property Insights of Rilmakalim
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rilmakalim. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Rilmakalim. Following Lipinski's Rule of Five, Rilmakalim has 1 hydrogen bond donor(s) and 5 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 Rilmakalim?
The CAS number of Rilmakalim is 132014-21-2.
What is the molecular formula of Rilmakalim?
The molecular formula of Rilmakalim is C21H23NO5S.
What is the molecular weight of Rilmakalim?
The molecular weight of Rilmakalim is 401.13 g/mol.
Where can I buy Rilmakalim?
You can request a quote for Rilmakalim directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rilmakalim?
Yes, KEHONG BIO provides custom synthesis services for Rilmakalim and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.