5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride
TL;DR: 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride (CAS 680617-94-1) is a chemical compound with molecular formula C17H19ClN2O4S and molecular weight 382.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-(dimethylamino)benzoyl]amino]-2-ethoxybenzenesulfonyl chloride
Also Known As: 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride, 2958AJ, 2,3,5,6-Tetrachloroisonicotinaldehyde, 5-(4-DIMETHYLAMINO-BENZOYLAMINO)-2-ETHOXY-BENZENESULFONYL CHLORIDE, 5-[[4-(dimethylamino)benzoyl]amino]-2-ethoxybenzenesulfonyl chloride
| Molecular Formula | C17H19ClN2O4S |
|---|---|
| Molecular Weight | 382.08 g/mol |
| LogP | 3.3311 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.0754 |
| Heavy Atoms | 25 |
| Complexity | 864.7166 |
Chemical Identifiers
| CAS Number | 680617-94-1 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)N(C)C)S(=O)(=O)Cl |
Product Overview
5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride (CAS 680617-94-1), with molecular formula C17H19ClN2O4S and molecular weight 382.08 g/mol. IUPAC: 5-[[4-(dimethylamino)benzoyl]amino]-2-ethoxybenzenesulfonyl chloride.
Chemical Property Profile of 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride
Property Insights of 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride
The XLogP value of 3.3311 indicates that 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride. Following Lipinski's Rule of Five, 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride has 1 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 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride?
The CAS number of 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride is 680617-94-1.
What is the molecular formula of 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride?
The molecular formula of 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride is C17H19ClN2O4S.
What is the molecular weight of 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride?
The molecular weight of 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride is 382.08 g/mol.
Where can I buy 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride?
You can request a quote for 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-(Dimethylamino)benzamido)-2-ethoxybenzene-1-sulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.