![2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide structure](/static/products/5552/5552-93-2.webp)
2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide
TL;DR: 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide (CAS 5552-93-2) is a chemical compound with molecular formula C30H28ClN3O5S and molecular weight 577.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide
Also Known As: 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide, N-({N'-[(E)-[4-(BENZYLOXY)-3-ETHOXYPHENYL]METHYLIDENE]HYDRAZINECARBONYL}METHYL)-N-(3-CHLOROPHENYL)BENZENESULFONAMIDE, N-(2-{(2E)-2-[4-(benzyloxy)-3-ethoxybenzylidene]hydrazinyl}-2-oxoethyl)-N-(3-chlorophenyl)benzenesulfonamide (non-preferred name), N-{2-[(2E)-2-{[4-(Benzyloxy)-3-ethoxyphenyl]methylidene}hydrazin-1-yl]-2-oxoethyl}-N-(3-chlorophenyl)benzenesulfonamide, Phosphorodithioic acid, O,O-diethyl ester, S-ester with 3-(N-cyclohexyl-2-mercaptoacetamido)tetrahydrothiophene 1,1-dioxide
| Molecular Formula | C30H28ClN3O5S |
|---|---|
| Molecular Weight | 577.14 g/mol |
| LogP | 5.6633 |
| Topological Polar Surface Area | 97.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 577.1438 |
| Heavy Atoms | 40 |
| Complexity | 1565.0477 |
Chemical Identifiers
| CAS Number | 5552-93-2 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=N/NC(=O)CN(C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=CC=C3)OCC4=CC=CC=C4 |
Product Overview
2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide (CAS 5552-93-2), with molecular formula C30H28ClN3O5S and molecular weight 577.14 g/mol. IUPAC: 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide.
Chemical Property Profile of 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide
Property Insights of 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide
The XLogP value of 5.6633 indicates that 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide. Following Lipinski's Rule of Five, 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide?
The CAS number of 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide is 5552-93-2.
What is the molecular formula of 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide?
The molecular formula of 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide is C30H28ClN3O5S.
What is the molecular weight of 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide?
The molecular weight of 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide is 577.14 g/mol.
Where can I buy 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide?
You can request a quote for 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[N-(benzenesulfonyl)-3-chloroanilino]-N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.