(2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid
TL;DR: (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid (CAS 352665-93-1) is a chemical compound with molecular formula C13H17NO6S and molecular weight 315.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methylbutanoic acid
Also Known As: BAS 05992979, (2S)-2-(2,3-DIHYDRO-1,4-BENZODIOXINE-6-SULFONAMIDO)-3-METHYLBUTANOIC ACID, (2S)-2-[(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]-3-methylbutanoic acid, (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methylbutanoic acid, (2S)-2-(2,3-DIHYDRO-1,4-BENZODIOXINE-6-SULFONAMIDO)-3-METHYLBUTANOICACID
| Molecular Formula | C13H17NO6S |
|---|---|
| Molecular Weight | 315.08 g/mol |
| LogP | 0.8453 |
| Topological Polar Surface Area | 101.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.07767 |
| Heavy Atoms | 21 |
| Complexity | 640.0616 |
Chemical Identifiers
| CAS Number | 352665-93-1 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2 |
Product Overview
(2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid (CAS 352665-93-1), with molecular formula C13H17NO6S and molecular weight 315.08 g/mol. IUPAC: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methylbutanoic acid.
Chemical Property Profile of (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid
Property Insights of (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid
The XLogP value of 0.8453 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid. The TPSA of 101.93 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid. Following Lipinski's Rule of Five, (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid has 2 hydrogen bond donor(s) and 5 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 (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid?
The CAS number of (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid is 352665-93-1.
What is the molecular formula of (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid?
The molecular formula of (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid is C13H17NO6S.
What is the molecular weight of (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid?
The molecular weight of (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid is 315.08 g/mol.
Where can I buy (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid?
You can request a quote for (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-(2,3-Dihydro-1,4-benzodioxine-6-sulfonamido)-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.