![3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid structure](/static/products/1607/16077-16-0.webp)
3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid
TL;DR: 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid (CAS 16077-16-0) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid
Also Known As: 3-methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid, 3-methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 16077-16-0 |
|---|---|
| SMILES | CC1C(CC2=C1NC3=CC=CC=C23)C(=O)O |
| InChIKey | PURWTPKEGVGRRB-UHFFFAOYSA-N |
Product Overview
3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid (CAS 16077-16-0), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: 3-methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid.
Chemical Property Profile of 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid
Property Insights of 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid. With a topological polar surface area (TPSA) of 53.1 Ų, 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid has 2 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 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid?
The CAS number of 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid is 16077-16-0.
What is the molecular formula of 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid?
The molecular formula of 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid is C13H13NO2.
What is the molecular weight of 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid?
The molecular weight of 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid is 215.09 g/mol.
Where can I buy 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid?
You can request a quote for 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1,2,3,4-tetrahydrocyclopenta[b]indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.