6-Chlorogramine
TL;DR: 6-Chlorogramine (CAS 5017-12-9) is a chemical compound with molecular formula C11H13ClN2 and molecular weight 208.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-chloro-1H-indol-3-yl)-N,N-dimethylmethanamine
Also Known As: 6-Chlorogramine, 6-Chlor-gramin, 6-chloro-gramine, 1-(6-chloro-1h-indol-3-yl)-n,n-dimethylmethanamine, KST-1B5332
| Molecular Formula | C11H13ClN2 |
|---|---|
| Molecular Weight | 208.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 19.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.07672 |
| Heavy Atoms | 14 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 5017-12-9 |
|---|---|
| SMILES | CN(C)CC1=CNC2=C1C=CC(=C2)Cl |
| InChIKey | PQOIPGFSMNOWAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chlorogramine (CAS 5017-12-9), with molecular formula C11H13ClN2 and molecular weight 208.08 g/mol. IUPAC: 1-(6-chloro-1H-indol-3-yl)-N,N-dimethylmethanamine.
Chemical Property Profile of 6-Chlorogramine
Property Insights of 6-Chlorogramine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chlorogramine. With a topological polar surface area (TPSA) of 19.0 Ų, 6-Chlorogramine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chlorogramine has 1 hydrogen bond donor(s) and 1 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 6-Chlorogramine?
The CAS number of 6-Chlorogramine is 5017-12-9.
What is the molecular formula of 6-Chlorogramine?
The molecular formula of 6-Chlorogramine is C11H13ClN2.
What is the molecular weight of 6-Chlorogramine?
The molecular weight of 6-Chlorogramine is 208.08 g/mol.
Where can I buy 6-Chlorogramine?
You can request a quote for 6-Chlorogramine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chlorogramine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chlorogramine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.