9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester
TL;DR: 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester (CAS 60706-06-1) is a chemical compound with molecular formula C15H13NO3 and molecular weight 255.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-methyl-4-oxopyrrolo[1,2-a]indole-2-carboxylate
Also Known As: ChemDiv2_001679, ethyl 1-methyl-4-oxopyrrolo[1,2-a]indole-2-carboxylate, ethyl 3-methyl-9-oxo-9H-pyrrolo[1,2-a]indole-2-carboxylate, 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester
| Molecular Formula | C15H13NO3 |
|---|---|
| Molecular Weight | 255.09 g/mol |
| LogP | 2.50682 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.08954 |
| Heavy Atoms | 19 |
| Complexity | 697.4114 |
Chemical Identifiers
| CAS Number | 60706-06-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(N2C3=CC=CC=C3C(=O)C2=C1)C |
Product Overview
9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester (CAS 60706-06-1), with molecular formula C15H13NO3 and molecular weight 255.09 g/mol. IUPAC: ethyl 1-methyl-4-oxopyrrolo[1,2-a]indole-2-carboxylate.
Chemical Property Profile of 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester
Property Insights of 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester
The XLogP value of 2.50682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester. With a topological polar surface area (TPSA) of 48.3 Ų, 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester has 0 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 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester?
The CAS number of 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester is 60706-06-1.
What is the molecular formula of 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester?
The molecular formula of 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester is C15H13NO3.
What is the molecular weight of 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester?
The molecular weight of 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester is 255.09 g/mol.
Where can I buy 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester?
You can request a quote for 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 9H-Pyrrolo[1,2-a]indole-2-carboxylic acid, 3-methyl-9-oxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.