3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole
TL;DR: 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole (CAS 76325-80-9) is a chemical compound with molecular formula C20H23NO3 and molecular weight 325.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(1-adamantyl)-2-oxoethyl]-3-hydroxy-1H-indol-2-one
Also Known As: 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole, 3-(2-(Adamantan-1-yl)-2-oxoethyl)-3-hydroxyindolin-2-one, 3-[2-(1-adamantyl)-2-oxoethyl]-3-hydroxy-1H-indol-2-one, 3-[2-(1-adamantyl)-2-oxo-ethyl]-3-hydroxy-1H-indol-2-one, 5-Bromo-3-hydroxy-3-(2-oxo-propyl)-1,3-dihydro-indol-2-one
| Molecular Formula | C20H23NO3 |
|---|---|
| Molecular Weight | 325.17 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.1678 |
| Heavy Atoms | 24 |
| Complexity | 544.0 |
Chemical Identifiers
| CAS Number | 76325-80-9 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)CC4(C5=CC=CC=C5NC4=O)O |
| InChIKey | LITDNYDOOKSWGY-UHFFFAOYSA-N |
Product Overview
3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole (CAS 76325-80-9), with molecular formula C20H23NO3 and molecular weight 325.17 g/mol. IUPAC: 3-[2-(1-adamantyl)-2-oxoethyl]-3-hydroxy-1H-indol-2-one.
Chemical Property Profile of 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole
Property Insights of 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole. Following Lipinski's Rule of Five, 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole has 2 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 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole?
The CAS number of 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole is 76325-80-9.
What is the molecular formula of 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole?
The molecular formula of 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole is C20H23NO3.
What is the molecular weight of 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole?
The molecular weight of 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole is 325.17 g/mol.
Where can I buy 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole?
You can request a quote for 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-adamantanoylmethyl)-3-hydroxy-2-oxoindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.