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N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine
TL;DR: N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine (CAS 477852-27-0) is a chemical compound with molecular formula C13H10N2O3S and molecular weight 274.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-nitro-4-phenylsulfanylphenyl)methylidene]hydroxylamine
Also Known As: 3-nitro-4-(phenylsulfanyl)benzenecarbaldehyde oxime, N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine, N-[(3-nitro-4-phenylsulfanylphenyl)methylidene]hydroxylamine
| Molecular Formula | C13H10N2O3S |
|---|---|
| Molecular Weight | 274.04 g/mol |
| LogP | 3.5541 |
| Topological Polar Surface Area | 75.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.0412 |
| Heavy Atoms | 19 |
| Complexity | 614.54034 |
Chemical Identifiers
| CAS Number | 477852-27-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=C(C=C(C=C2)C=NO)[N+](=O)[O-] |
Product Overview
N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine (CAS 477852-27-0), with molecular formula C13H10N2O3S and molecular weight 274.04 g/mol. IUPAC: N-[(3-nitro-4-phenylsulfanylphenyl)methylidene]hydroxylamine.
Chemical Property Profile of N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine
Property Insights of N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine
The XLogP value of 3.5541 indicates that N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.73 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine. Following Lipinski's Rule of Five, N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine 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 N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine?
The CAS number of N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine is 477852-27-0.
What is the molecular formula of N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine?
The molecular formula of N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine is C13H10N2O3S.
What is the molecular weight of N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine?
The molecular weight of N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine is 274.04 g/mol.
Where can I buy N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine?
You can request a quote for N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine?
Yes, KEHONG BIO provides custom synthesis services for N-{[3-nitro-4-(phenylsulfanyl)phenyl]methylidene}hydroxylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.