4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole
TL;DR: 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole (CAS 62658-85-9) is a chemical compound with molecular formula C16H24N2O2 and molecular weight 276.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-ol
Also Known As: 2-Debenzoyl rac Bopindolol, 4- -2-methylindole, Sandoz-21-009, San 21009, Sdz 21-009
| Molecular Formula | C16H24N2O2 |
|---|---|
| Molecular Weight | 276.18 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 57.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 276.18378 |
| Heavy Atoms | 20 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 62658-85-9 |
|---|---|
| SMILES | CC1=CC2=C(N1)C=CC=C2OCC(CNC(C)(C)C)O |
| InChIKey | BGQHPLYSXBZMQG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole (CAS 62658-85-9), with molecular formula C16H24N2O2 and molecular weight 276.18 g/mol. IUPAC: 1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-ol.
Chemical Property Profile of 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole
Property Insights of 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole. With a topological polar surface area (TPSA) of 57.3 Ų, 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole has 3 hydrogen bond donor(s) and 3 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 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole?
The CAS number of 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole is 62658-85-9.
What is the molecular formula of 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole?
The molecular formula of 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole is C16H24N2O2.
What is the molecular weight of 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole?
The molecular weight of 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole is 276.18 g/mol.
Where can I buy 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole?
You can request a quote for 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.