![3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid structure](/static/products/794/794552-37-7.png)
3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid
TL;DR: 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid (CAS 794552-37-7) is a chemical compound with molecular formula C15H14N2O5S and molecular weight 334.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(1-methyl-2-oxobenzo[cd]indol-6-yl)sulfonylamino]propanoic acid
Also Known As: BAS 09620449, AQ-390/42297097, 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid, 3-[(1-methyl-2-oxobenzo[cd]indol-6-yl)sulfonylamino]propanoic acid, N-[(1-methyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)sulfonyl]-beta-alanine
| Molecular Formula | C15H14N2O5S |
|---|---|
| Molecular Weight | 334.06 g/mol |
| LogP | 1.1828 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.06235 |
| Heavy Atoms | 23 |
| Complexity | 936.27795 |
Chemical Identifiers
| CAS Number | 794552-37-7 |
|---|---|
| SMILES | CN1C2=C3C(=C(C=C2)S(=O)(=O)NCCC(=O)O)C=CC=C3C1=O |
Product Overview
3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid (CAS 794552-37-7), with molecular formula C15H14N2O5S and molecular weight 334.06 g/mol. IUPAC: 3-[(1-methyl-2-oxobenzo[cd]indol-6-yl)sulfonylamino]propanoic acid.
Chemical Property Profile of 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid
Property Insights of 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid
The XLogP value of 1.1828 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid. The TPSA of 103.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid. Following Lipinski's Rule of Five, 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid has 2 hydrogen bond donor(s) and 4 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-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid?
The CAS number of 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid is 794552-37-7.
What is the molecular formula of 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid?
The molecular formula of 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid is C15H14N2O5S.
What is the molecular weight of 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid?
The molecular weight of 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid is 334.06 g/mol.
Where can I buy 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid?
You can request a quote for 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonylamino)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.