1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)-
TL;DR: 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)- (CAS 99448-75-6) is a chemical compound with molecular formula C16H13NO2 and molecular weight 251.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-methylindole-2,3-dione
Also Known As: 1-benzyl-5-methylisatin, 1-benzyl-5-methylindoline-2,3-dione, 1-Benzyl-5-methyl-1H-indole-2,3-dione, 1-benzyl-5-methylindole-2,3-dione, 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)-
| Molecular Formula | C16H13NO2 |
|---|---|
| Molecular Weight | 251.09 g/mol |
| LogP | 2.72452 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.09464 |
| Heavy Atoms | 19 |
| Complexity | 661.7041 |
Chemical Identifiers
| CAS Number | 99448-75-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(=O)C2=O)CC3=CC=CC=C3 |
Product Overview
1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)- (CAS 99448-75-6), with molecular formula C16H13NO2 and molecular weight 251.09 g/mol. IUPAC: 1-benzyl-5-methylindole-2,3-dione.
Chemical Property Profile of 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)-
Property Insights of 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)-
The XLogP value of 2.72452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)-. With a topological polar surface area (TPSA) of 37.38 Ų, 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)- has 0 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 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)-?
The CAS number of 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)- is 99448-75-6.
What is the molecular formula of 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)-?
The molecular formula of 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)- is C16H13NO2.
What is the molecular weight of 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)-?
The molecular weight of 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)- is 251.09 g/mol.
Where can I buy 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)-?
You can request a quote for 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-2,3-dione, 5-methyl-1-(phenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.