![3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid structure](/static/products/1164/1164523-41-4.webp)
3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid
TL;DR: 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid (CAS 1164523-41-4) is a chemical compound with molecular formula C13H17NO5S and molecular weight 299.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-(3-hydroxypropylsulfamoyl)-4-methylphenyl]prop-2-enoic acid
Also Known As: 3-(3-{[(3-hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid, (2E)-3-{3-[(3-hydroxypropyl)sulfamoyl]-4-methylphenyl}prop-2-enoic acid, (E)-3-(3-(N-(3-hydroxypropyl)sulfamoyl)-4-methylphenyl)acrylic acid, (E)-3-[3-(3-hydroxypropylsulfamoyl)-4-methylphenyl]prop-2-enoic acid, (2E)-3-(3-{[(3-hydroxypropyl)amino]sulfonyl}-4-methylphenyl)prop-2-enoic acid
| Molecular Formula | C13H17NO5S |
|---|---|
| Molecular Weight | 299.08 g/mol |
| LogP | 0.75352 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 299.08273 |
| Heavy Atoms | 20 |
| Complexity | 607.18756 |
Chemical Identifiers
| CAS Number | 1164523-41-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)/C=C/C(=O)O)S(=O)(=O)NCCCO |
Product Overview
3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid (CAS 1164523-41-4), with molecular formula C13H17NO5S and molecular weight 299.08 g/mol. IUPAC: (E)-3-[3-(3-hydroxypropylsulfamoyl)-4-methylphenyl]prop-2-enoic acid.
Chemical Property Profile of 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid
Property Insights of 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid
The XLogP value of 0.75352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid. Following Lipinski's Rule of Five, 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid has 3 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-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid?
The CAS number of 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid is 1164523-41-4.
What is the molecular formula of 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid?
The molecular formula of 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid is C13H17NO5S.
What is the molecular weight of 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid?
The molecular weight of 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid is 299.08 g/mol.
Where can I buy 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid?
You can request a quote for 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-{[(3-Hydroxypropyl)amino]sulfonyl}-4-methylphenyl)acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.