Disulergine
TL;DR: Disulergine (CAS 59032-40-5) is a chemical compound with molecular formula C17H24N4O2S and molecular weight 348.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aR,9S,10aR)-9-(dimethylsulfamoylamino)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline
Also Known As: Disulergine, Disulergina, Disulerginum, Sulergin, Disulergine [INN]
| Molecular Formula | C17H24N4O2S |
|---|---|
| Molecular Weight | 348.16 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 76.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.162 |
| Heavy Atoms | 24 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 59032-40-5 |
|---|---|
| SMILES | CN1C[C@H](C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)NS(=O)(=O)N(C)C |
| InChIKey | VUEGYUOUAAVYAS-JGGQBBKZSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Disulergine (CAS 59032-40-5), with molecular formula C17H24N4O2S and molecular weight 348.16 g/mol. IUPAC: (6aR,9S,10aR)-9-(dimethylsulfamoylamino)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline.
Chemical Property Profile of Disulergine
Property Insights of Disulergine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Disulergine. The TPSA of 76.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Disulergine. Following Lipinski's Rule of Five, Disulergine has 2 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 Disulergine?
The CAS number of Disulergine is 59032-40-5.
What is the molecular formula of Disulergine?
The molecular formula of Disulergine is C17H24N4O2S.
What is the molecular weight of Disulergine?
The molecular weight of Disulergine is 348.16 g/mol.
Where can I buy Disulergine?
You can request a quote for Disulergine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disulergine?
Yes, KEHONG BIO provides custom synthesis services for Disulergine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.