![N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide structure](/static/products/898/898915-68-9.png)
N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
TL;DR: N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide (CAS 898915-68-9) is a chemical compound with molecular formula C18H17NO3S and molecular weight 327.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-prop-2-enylsulfanylphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Also Known As: N-(2-(allylthio)phenyl)-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxamide, N-(2-prop-2-enylsulfanylphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide, N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
| Molecular Formula | C18H17NO3S |
|---|---|
| Molecular Weight | 327.09 g/mol |
| LogP | 3.9882 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.09293 |
| Heavy Atoms | 23 |
| Complexity | 729.95667 |
Chemical Identifiers
| CAS Number | 898915-68-9 |
|---|---|
| SMILES | C=CCSC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)OCCO3 |
Product Overview
N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide (CAS 898915-68-9), with molecular formula C18H17NO3S and molecular weight 327.09 g/mol. IUPAC: N-(2-prop-2-enylsulfanylphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide.
Chemical Property Profile of N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Property Insights of N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
The XLogP value of 3.9882 indicates that N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide has 1 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 N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide?
The CAS number of N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide is 898915-68-9.
What is the molecular formula of N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide?
The molecular formula of N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide is C18H17NO3S.
What is the molecular weight of N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide?
The molecular weight of N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide is 327.09 g/mol.
Where can I buy N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide?
You can request a quote for N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(prop-2-en-1-ylsulfanyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.