A1470/0064822
TL;DR: A1470/0064822 (CAS 5543-40-8) is a chemical compound with molecular formula C17H16BrN3O4S and molecular weight 437.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-bromophenyl)methylsulfanyl]-N-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]acetamide
Also Known As: A1470/0064822, 2-[(2-bromobenzyl)thio]-N'-(4-methoxy-3-nitrobenzylidene)acetohydrazide, 2-[(2-bromobenzyl)sulfanyl]-N'-[(E)-(4-methoxy-3-nitrophenyl)methylidene]acetohydrazide, 2-[(2-bromophenyl)methylsulfanyl]-N-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]acetamide, PHOSPHORODITHIOIC ACID,O,O-DIETHYL S-[(2-PYRIMIDINYLTHIO)METHYL] ESTER (7CI,8CI)
| Molecular Formula | C17H16BrN3O4S |
|---|---|
| Molecular Weight | 437.00 g/mol |
| LogP | 3.7494 |
| Topological Polar Surface Area | 93.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 437.0045 |
| Heavy Atoms | 26 |
| Complexity | 829.40533 |
Chemical Identifiers
| CAS Number | 5543-40-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=N/NC(=O)CSCC2=CC=CC=C2Br)[N+](=O)[O-] |
Product Overview
A1470/0064822 (CAS 5543-40-8), with molecular formula C17H16BrN3O4S and molecular weight 437.00 g/mol. IUPAC: 2-[(2-bromophenyl)methylsulfanyl]-N-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]acetamide.
Chemical Property Profile of A1470/0064822
Property Insights of A1470/0064822
The XLogP value of 3.7494 indicates that A1470/0064822 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.83 Ų falls within the moderate polarity range, balancing permeability and solubility for A1470/0064822. Following Lipinski's Rule of Five, A1470/0064822 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 A1470/0064822?
The CAS number of A1470/0064822 is 5543-40-8.
What is the molecular formula of A1470/0064822?
The molecular formula of A1470/0064822 is C17H16BrN3O4S.
What is the molecular weight of A1470/0064822?
The molecular weight of A1470/0064822 is 437.00 g/mol.
Where can I buy A1470/0064822?
You can request a quote for A1470/0064822 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1470/0064822?
Yes, KEHONG BIO provides custom synthesis services for A1470/0064822 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.