N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan
TL;DR: N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan (CAS 1008587-24-3) is a chemical compound with molecular formula C19H18N2O6S and molecular weight 402.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-(1H-indol-3-yl)propanoic acid
Also Known As: N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan, ZERO/006231, BAS 13090981, 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-(1H-indol-3-yl)propanoic acid, tryptophan, N-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]-
| Molecular Formula | C19H18N2O6S |
|---|---|
| Molecular Weight | 402.09 g/mol |
| LogP | 1.9133 |
| Topological Polar Surface Area | 117.72 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.08856 |
| Heavy Atoms | 28 |
| Complexity | 1138.2863 |
Chemical Identifiers
| CAS Number | 1008587-24-3 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O |
Product Overview
N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan (CAS 1008587-24-3), with molecular formula C19H18N2O6S and molecular weight 402.09 g/mol. IUPAC: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-(1H-indol-3-yl)propanoic acid.
Chemical Property Profile of N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan
Property Insights of N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan
The XLogP value of 1.9133 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan. The TPSA of 117.72 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan. Following Lipinski's Rule of Five, N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan has 3 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 N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan?
The CAS number of N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan is 1008587-24-3.
What is the molecular formula of N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan?
The molecular formula of N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan is C19H18N2O6S.
What is the molecular weight of N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan?
The molecular weight of N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan is 402.09 g/mol.
Where can I buy N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan?
You can request a quote for N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan?
Yes, KEHONG BIO provides custom synthesis services for N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)tryptophan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.