A1553/0067649
TL;DR: A1553/0067649 (CAS 5546-21-4) is a chemical compound with molecular formula C27H24N4O6S and molecular weight 532.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(benzenesulfonyl)-2,5-dimethylanilino]-N-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]acetamide
Also Known As: A1553/0067649, N-(2,5-dimethylphenyl)-N-[2-(2-{[5-(4-nitrophenyl)-2-furyl]methylene}hydrazino)-2-oxoethyl]benzenesulfonamide, N-(2,5-dimethylphenyl)-N-[2-(2-{[5-(4-nitrophenyl)-2-furyl]methylene}hydrazino)-2-oxoethyl]benzenesulfonamide (non-preferred name), 2-[N-(benzenesulfonyl)-2,5-dimethylanilino]-N-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]acetamide, 2-(N-besyl-2,5-dimethyl-anilino)-N-[[5-(4-nitrophenyl)-2-furyl]methyleneamino]acetamide
| Molecular Formula | C27H24N4O6S |
|---|---|
| Molecular Weight | 532.14 g/mol |
| LogP | 4.81724 |
| Topological Polar Surface Area | 135.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 532.14166 |
| Heavy Atoms | 38 |
| Complexity | 1596.2892 |
Chemical Identifiers
| CAS Number | 5546-21-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)N(CC(=O)N/N=C/C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CC=C4 |
Product Overview
A1553/0067649 (CAS 5546-21-4), with molecular formula C27H24N4O6S and molecular weight 532.14 g/mol. IUPAC: 2-[N-(benzenesulfonyl)-2,5-dimethylanilino]-N-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]acetamide.
Chemical Property Profile of A1553/0067649
Property Insights of A1553/0067649
The XLogP value of 4.81724 indicates that A1553/0067649 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.12 Ų falls within the moderate polarity range, balancing permeability and solubility for A1553/0067649. Following Lipinski's Rule of Five, A1553/0067649 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1553/0067649?
The CAS number of A1553/0067649 is 5546-21-4.
What is the molecular formula of A1553/0067649?
The molecular formula of A1553/0067649 is C27H24N4O6S.
What is the molecular weight of A1553/0067649?
The molecular weight of A1553/0067649 is 532.14 g/mol.
Where can I buy A1553/0067649?
You can request a quote for A1553/0067649 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1553/0067649?
Yes, KEHONG BIO provides custom synthesis services for A1553/0067649 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.