N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine
TL;DR: N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine (CAS 114426-23-2) is a chemical compound with molecular formula C9H9NO3S and molecular weight 211.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine
Also Known As: 2,3-dihydro-4H-thiochromen-4-one oxime 1,1-dioxide, N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine
| Molecular Formula | C9H9NO3S |
|---|---|
| Molecular Weight | 211.03 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 75.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 211.03032 |
| Heavy Atoms | 14 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 114426-23-2 |
|---|---|
| SMILES | C1CS(=O)(=O)C2=CC=CC=C2C1=NO |
| InChIKey | WBAJTBLIYAEXCU-UHFFFAOYSA-N |
Product Overview
N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine (CAS 114426-23-2), with molecular formula C9H9NO3S and molecular weight 211.03 g/mol. IUPAC: N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine.
Chemical Property Profile of N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine
Property Insights of N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine. The TPSA of 75.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine. Following Lipinski's Rule of Five, N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine has 1 hydrogen bond donor(s) and 4 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-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine?
The CAS number of N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine is 114426-23-2.
What is the molecular formula of N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine?
The molecular formula of N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine is C9H9NO3S.
What is the molecular weight of N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine?
The molecular weight of N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine is 211.03 g/mol.
Where can I buy N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine?
You can request a quote for N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine?
Yes, KEHONG BIO provides custom synthesis services for N-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)hydroxylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.