![N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide structure](/static/products/832/832136-31-9.png)
N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide
TL;DR: N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide (CAS 832136-31-9) is a chemical compound with molecular formula C21H16ClNO6S and molecular weight 445.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-1,3-benzodioxole-5-carboxamide
Also Known As: N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide, N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-1,3-benzodioxole-5-carboxamide, N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]benzo[1,3]dioxole-5-carboxamide
| Molecular Formula | C21H16ClNO6S |
|---|---|
| Molecular Weight | 445.04 g/mol |
| LogP | 4.1624 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 445.0387 |
| Heavy Atoms | 30 |
| Complexity | 1224.744 |
Chemical Identifiers
| CAS Number | 832136-31-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)Cl |
Product Overview
N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide (CAS 832136-31-9), with molecular formula C21H16ClNO6S and molecular weight 445.04 g/mol. IUPAC: N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide
Property Insights of N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide
The XLogP value of 4.1624 indicates that N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide. Following Lipinski's Rule of Five, N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide has 1 hydrogen bond donor(s) and 6 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-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide?
The CAS number of N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide is 832136-31-9.
What is the molecular formula of N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide is C21H16ClNO6S.
What is the molecular weight of N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide is 445.04 g/mol.
Where can I buy N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-{3-[(4-chlorophenyl)sulfonyl]-5-methoxyphenyl}-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.