1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one
TL;DR: 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one (CAS 1005090-37-8) is a chemical compound with molecular formula C19H25NO4 and molecular weight 331.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one
Also Known As: 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one, 1-(sec-butyl)-3-(6,6-dimethyl-4-oxotetrahydro-2H-pyran-3-yl)-3-hydroxyindolin-2-one, 1-(butan-2-yl)-3-(6,6-dimethyl-4-oxotetrahydro-2H-pyran-3-yl)-3-hydroxy-1,3-dihydro-2H-indol-2-one
| Molecular Formula | C19H25NO4 |
|---|---|
| Molecular Weight | 331.18 g/mol |
| LogP | 2.4035 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.17834 |
| Heavy Atoms | 24 |
| Complexity | 683.6993 |
Chemical Identifiers
| CAS Number | 1005090-37-8 |
|---|---|
| SMILES | CCC(C)N1C2=CC=CC=C2C(C1=O)(C3COC(CC3=O)(C)C)O |
Product Overview
1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one (CAS 1005090-37-8), with molecular formula C19H25NO4 and molecular weight 331.18 g/mol. IUPAC: 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one.
Chemical Property Profile of 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one
Property Insights of 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one
The XLogP value of 2.4035 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one. Following Lipinski's Rule of Five, 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one has 1 hydrogen bond donor(s) and 4 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 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one?
The CAS number of 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one is 1005090-37-8.
What is the molecular formula of 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one?
The molecular formula of 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one is C19H25NO4.
What is the molecular weight of 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one?
The molecular weight of 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one is 331.18 g/mol.
Where can I buy 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one?
You can request a quote for 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-butan-2-yl-3-(6,6-dimethyl-4-oxooxan-3-yl)-3-hydroxyindol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.