Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate
TL;DR: Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS 73975-59-4) is a chemical compound with molecular formula C12H13NO3 and molecular weight 219.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-hydroxy-1,2-dimethylindole-3-carboxylate
Also Known As: Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate, methyl 5-hydroxy-1,2-dimethylindole-3-carboxylate, A0057/0002453, Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate #, Indole-3-carboxylic acid, 5-hydroxy-1,2-dimethyl-, methyl ester
| Molecular Formula | C12H13NO3 |
|---|---|
| Molecular Weight | 219.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 51.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.08954 |
| Heavy Atoms | 16 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 73975-59-4 |
|---|---|
| SMILES | CC1=C(C2=C(N1C)C=CC(=C2)O)C(=O)OC |
| InChIKey | JTPMSTFUJJHJRW-UHFFFAOYSA-N |
Product Overview
Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS 73975-59-4), with molecular formula C12H13NO3 and molecular weight 219.09 g/mol. IUPAC: methyl 5-hydroxy-1,2-dimethylindole-3-carboxylate.
Chemical Property Profile of Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate
Property Insights of Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate. With a topological polar surface area (TPSA) of 51.5 Ų, Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate 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 Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate?
The CAS number of Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate is 73975-59-4.
What is the molecular formula of Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate?
The molecular formula of Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate is C12H13NO3.
What is the molecular weight of Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate?
The molecular weight of Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate is 219.09 g/mol.
Where can I buy Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate?
You can request a quote for Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.