Indole, 3-bromoacetyl-5-(dimethylamino)-
TL;DR: Indole, 3-bromoacetyl-5-(dimethylamino)- (CAS 6851-69-0) is a chemical compound with molecular formula C12H13BrN2O and molecular weight 280.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-[5-(dimethylamino)-1H-indol-3-yl]ethanone
Also Known As: 5-(Dimethylamino)-3-bromoacetylindole, INDOLE, 3-BROMOACETYL-5-(DIMETHYLAMINO)-, 3-Bromacetyl-5-dimethylamino-indol, 2-bromo-1-[5-(dimethylamino)-1H-indol-3-yl]ethanone, 2-Bromo-1-[5-(dimethylamino)-1H-indol-3-yl]ethan-1-one
| Molecular Formula | C12H13BrN2O |
|---|---|
| Molecular Weight | 280.02 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.02112 |
| Heavy Atoms | 16 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 6851-69-0 |
|---|---|
| SMILES | CN(C)C1=CC2=C(C=C1)NC=C2C(=O)CBr |
| InChIKey | OOYNNWHPLINKIW-UHFFFAOYSA-N |
Product Overview
Indole, 3-bromoacetyl-5-(dimethylamino)- (CAS 6851-69-0), with molecular formula C12H13BrN2O and molecular weight 280.02 g/mol. IUPAC: 2-bromo-1-[5-(dimethylamino)-1H-indol-3-yl]ethanone.
Chemical Property Profile of Indole, 3-bromoacetyl-5-(dimethylamino)-
Property Insights of Indole, 3-bromoacetyl-5-(dimethylamino)-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole, 3-bromoacetyl-5-(dimethylamino)-. With a topological polar surface area (TPSA) of 36.1 Ų, Indole, 3-bromoacetyl-5-(dimethylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole, 3-bromoacetyl-5-(dimethylamino)- 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 Indole, 3-bromoacetyl-5-(dimethylamino)-?
The CAS number of Indole, 3-bromoacetyl-5-(dimethylamino)- is 6851-69-0.
What is the molecular formula of Indole, 3-bromoacetyl-5-(dimethylamino)-?
The molecular formula of Indole, 3-bromoacetyl-5-(dimethylamino)- is C12H13BrN2O.
What is the molecular weight of Indole, 3-bromoacetyl-5-(dimethylamino)-?
The molecular weight of Indole, 3-bromoacetyl-5-(dimethylamino)- is 280.02 g/mol.
Where can I buy Indole, 3-bromoacetyl-5-(dimethylamino)-?
You can request a quote for Indole, 3-bromoacetyl-5-(dimethylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indole, 3-bromoacetyl-5-(dimethylamino)-?
Yes, KEHONG BIO provides custom synthesis services for Indole, 3-bromoacetyl-5-(dimethylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.