1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime
TL;DR: 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime (CAS 303149-17-9) is a chemical compound with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methylphenyl)methyl]-3-nitrosoindol-2-ol
Also Known As: 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime, 1-[(4-methylphenyl)methyl]-3-nitrosoindol-2-ol, 3-hydroxyimino-1-[(4-methylphenyl)methyl]indol-2-one, (3Z)-3-(hydroxyimino)-1-[(4-methylphenyl)methyl]-2,3-dihydro-1H-indol-2-one, (3E)-3-hydroxyimino-1-[(4-methylphenyl)methyl]indol-2-one
| Molecular Formula | C16H14N2O2 |
|---|---|
| Molecular Weight | 266.11 g/mol |
| LogP | 4.10152 |
| Topological Polar Surface Area | 54.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.10553 |
| Heavy Atoms | 20 |
| Complexity | 773.02124 |
Chemical Identifiers
| CAS Number | 303149-17-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2O)N=O |
Product Overview
1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime (CAS 303149-17-9), with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol. IUPAC: 1-[(4-methylphenyl)methyl]-3-nitrosoindol-2-ol.
Chemical Property Profile of 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime
Property Insights of 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime
The XLogP value of 4.10152 indicates that 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.59 Ų, 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime has 1 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 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime?
The CAS number of 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime is 303149-17-9.
What is the molecular formula of 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime?
The molecular formula of 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime is C16H14N2O2.
What is the molecular weight of 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime?
The molecular weight of 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime is 266.11 g/mol.
Where can I buy 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime?
You can request a quote for 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-methylbenzyl)-1H-indole-2,3-dione 3-oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.