5-二甲氨基吲哚-3-甲醛
TL;DR: 5-二甲氨基吲哚-3-甲醛 (CAS 6843-27-2) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-二甲氨基吲哚-3-甲醛
5-(dimethylamino)-1H-indole-3-carbaldehyde
Also Known As: 3-Formyl-5-dimethylamino indole, 5-Dimethylaminoindole-3-carboxaldehyde, INDOLE-3-CARBOXALDEHYDE, 5-DIMETHYLAMINO-, 5-(dimethylamino)-1H-indole-3-carbaldehyde, 5-22-13-00021 (Beilstein Handbook Reference)
| Molecular Formula | C11H12N2O |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.09496 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 6843-27-2 |
|---|---|
| SMILES | CN(C)C1=CC2=C(C=C1)NC=C2C=O |
| InChIKey | ZBXFRJNUAWOOCU-UHFFFAOYSA-N |
Product Overview
5-二甲氨基吲哚-3-甲醛 (CAS 6843-27-2), with molecular formula C11H12N2O and molecular weight 188.09 g/mol. IUPAC: 5-(dimethylamino)-1H-indole-3-carbaldehyde.
Chemical Property Profile of 5-二甲氨基吲哚-3-甲醛
Property Insights of 5-二甲氨基吲哚-3-甲醛
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-二甲氨基吲哚-3-甲醛. With a topological polar surface area (TPSA) of 36.1 Ų, 5-二甲氨基吲哚-3-甲醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-二甲氨基吲哚-3-甲醛 has 1 hydrogen bond donor(s) and 2 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 5-二甲氨基吲哚-3-甲醛?
The CAS number of 5-二甲氨基吲哚-3-甲醛 is 6843-27-2.
What is the molecular formula of 5-二甲氨基吲哚-3-甲醛?
The molecular formula of 5-二甲氨基吲哚-3-甲醛 is C11H12N2O.
What is the molecular weight of 5-二甲氨基吲哚-3-甲醛?
The molecular weight of 5-二甲氨基吲哚-3-甲醛 is 188.09 g/mol.
Where can I buy 5-二甲氨基吲哚-3-甲醛?
You can request a quote for 5-二甲氨基吲哚-3-甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-二甲氨基吲哚-3-甲醛?
Yes, KEHONG BIO provides custom synthesis services for 5-二甲氨基吲哚-3-甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.