3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide
TL;DR: 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide (CAS 121612-34-8) is a chemical compound with molecular formula C10H8ClNO4S2 and molecular weight 304.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide
Also Known As: BAS 00639603, 3-(4-chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide, 3-((4-chlorophenyl)thio)-4-nitro-2,5-dihydrothiophene 1,1-dioxide, 4-(4-chlorophenylthio)-3-nitro-2,5-dihydrothiophene-1,1-dione, 3-(4-Chloro-phenylsulfanyl)-4-nitro-2,5-dihydro-thiophene 1,1-dioxide
| Molecular Formula | C10H8ClNO4S2 |
|---|---|
| Molecular Weight | 304.96 g/mol |
| LogP | 2.3488 |
| Topological Polar Surface Area | 77.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.9583 |
| Heavy Atoms | 18 |
| Complexity | 621.7827 |
Chemical Identifiers
| CAS Number | 121612-34-8 |
|---|---|
| SMILES | C1C(=C(CS1(=O)=O)SC2=CC=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide (CAS 121612-34-8), with molecular formula C10H8ClNO4S2 and molecular weight 304.96 g/mol. IUPAC: 3-(4-chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide.
Chemical Property Profile of 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide
Property Insights of 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide
The XLogP value of 2.3488 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide. The TPSA of 77.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide has 0 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 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide?
The CAS number of 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide is 121612-34-8.
What is the molecular formula of 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide?
The molecular formula of 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide is C10H8ClNO4S2.
What is the molecular weight of 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide?
The molecular weight of 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide is 304.96 g/mol.
Where can I buy 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide?
You can request a quote for 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)sulfanyl-4-nitro-2,5-dihydrothiophene 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.