2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid
TL;DR: 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid (CAS 149286-91-9) is a chemical compound with molecular formula C10H9NO2S and molecular weight 207.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-sulfanylidene-1,3-dihydroindol-3-yl)acetic acid
Also Known As: 2-thioxo-1H-indole-3-alkanoic acid deriv. 5, 1H-Indole-3-acetic acid, 2,3-dihydro-2-thioxo-, 2-Thioxo-2,3-dihydro-1H-indole-3-acetic acid, (2-thioxo-2,3-dihydro-1H-indol-3-yl)acetic acid, 2-(2-sulfanylidene-1,3-dihydroindol-3-yl)acetic acid
| Molecular Formula | C10H9NO2S |
|---|---|
| Molecular Weight | 207.04 g/mol |
| LogP | 1.9978 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.0354 |
| Heavy Atoms | 14 |
| Complexity | 402.8634 |
Chemical Identifiers
| CAS Number | 149286-91-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(C(=S)N2)CC(=O)O |
Product Overview
2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid (CAS 149286-91-9), with molecular formula C10H9NO2S and molecular weight 207.04 g/mol. IUPAC: 2-(2-sulfanylidene-1,3-dihydroindol-3-yl)acetic acid.
Chemical Property Profile of 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid
Property Insights of 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid
The XLogP value of 1.9978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid. With a topological polar surface area (TPSA) of 49.33 Ų, 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic 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 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid?
The CAS number of 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid is 149286-91-9.
What is the molecular formula of 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid?
The molecular formula of 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid is C10H9NO2S.
What is the molecular weight of 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid?
The molecular weight of 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid is 207.04 g/mol.
Where can I buy 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid?
You can request a quote for 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-sulfanylidene-2,3-dihydro-1H-indol-3-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.