2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol
TL;DR: 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol (CAS 55654-91-6) is a chemical compound with molecular formula C18H20N2O and molecular weight 280.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzylamino)-1-(1-methylindol-3-yl)ethanol
Also Known As: alpha-((Benzylamino)methyl)-1-methylindole-3-methanol, 2-(benzylamino)-1-(1-methylindol-3-yl)ethanol, 5-22-12-00078 (Beilstein Handbook Reference), INDOLE-3-METHANOL, alpha-((BENZYLAMINO)METHYL)-1-METHYL-, 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol
| Molecular Formula | C18H20N2O |
|---|---|
| Molecular Weight | 280.16 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 37.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 280.15756 |
| Heavy Atoms | 21 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 55654-91-6 |
|---|---|
| SMILES | CN1C=C(C2=CC=CC=C21)C(CNCC3=CC=CC=C3)O |
| InChIKey | LUVRZHFKFRDWDK-UHFFFAOYSA-N |
Product Overview
2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol (CAS 55654-91-6), with molecular formula C18H20N2O and molecular weight 280.16 g/mol. IUPAC: 2-(benzylamino)-1-(1-methylindol-3-yl)ethanol.
Chemical Property Profile of 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol
Property Insights of 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol. With a topological polar surface area (TPSA) of 37.2 Ų, 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol has 2 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 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol?
The CAS number of 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol is 55654-91-6.
What is the molecular formula of 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol?
The molecular formula of 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol is C18H20N2O.
What is the molecular weight of 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol?
The molecular weight of 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol is 280.16 g/mol.
Where can I buy 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol?
You can request a quote for 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.