![2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline structure](/static/products/860/860786-01-2.png)
2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline
TL;DR: 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline (CAS 860786-01-2) is a chemical compound with molecular formula C14H13N3O3S and molecular weight 303.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline
Also Known As: 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline, 4-[(2-aminophenyl)sulfanyl]-3-nitrobenzenecarbaldehyde O-methyloxime
| Molecular Formula | C14H13N3O3S |
|---|---|
| Molecular Weight | 303.07 g/mol |
| LogP | 3.3085 |
| Topological Polar Surface Area | 90.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.06775 |
| Heavy Atoms | 21 |
| Complexity | 688.9145 |
Chemical Identifiers
| CAS Number | 860786-01-2 |
|---|---|
| SMILES | CON=CC1=CC(=C(C=C1)SC2=CC=CC=C2N)[N+](=O)[O-] |
Product Overview
2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline (CAS 860786-01-2), with molecular formula C14H13N3O3S and molecular weight 303.07 g/mol. IUPAC: 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline.
Chemical Property Profile of 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline
Property Insights of 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline
The XLogP value of 3.3085 indicates that 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline. Following Lipinski's Rule of Five, 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline 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 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline?
The CAS number of 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline is 860786-01-2.
What is the molecular formula of 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline?
The molecular formula of 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline is C14H13N3O3S.
What is the molecular weight of 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline?
The molecular weight of 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline is 303.07 g/mol.
Where can I buy 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline?
You can request a quote for 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(methoxyiminomethyl)-2-nitrophenyl]sulfanylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.