1-(2,4-Dinitro-phenylsulfanyl)-aziridine
TL;DR: 1-(2,4-Dinitro-phenylsulfanyl)-aziridine (CAS 7117-47-7) is a chemical compound with molecular formula C8H7N3O4S and molecular weight 241.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dinitrophenyl)sulfanylaziridine
Also Known As: 2,4-dinitrobenzensulfenyl aziridine, 1-(2,4-dinitrophenyl)sulfanylaziridine, 1-(2,4-DINITRO-PHENYLSULFANYL)-AZIRIDINE
| Molecular Formula | C8H7N3O4S |
|---|---|
| Molecular Weight | 241.02 g/mol |
| LogP | 1.8257 |
| Topological Polar Surface Area | 89.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 241.01573 |
| Heavy Atoms | 16 |
| Complexity | 460.59668 |
Chemical Identifiers
| CAS Number | 7117-47-7 |
|---|---|
| SMILES | C1CN1SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1-(2,4-Dinitro-phenylsulfanyl)-aziridine (CAS 7117-47-7), with molecular formula C8H7N3O4S and molecular weight 241.02 g/mol. IUPAC: 1-(2,4-dinitrophenyl)sulfanylaziridine.
Chemical Property Profile of 1-(2,4-Dinitro-phenylsulfanyl)-aziridine
Property Insights of 1-(2,4-Dinitro-phenylsulfanyl)-aziridine
The XLogP value of 1.8257 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,4-Dinitro-phenylsulfanyl)-aziridine. The TPSA of 89.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Dinitro-phenylsulfanyl)-aziridine. Following Lipinski's Rule of Five, 1-(2,4-Dinitro-phenylsulfanyl)-aziridine has 0 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 1-(2,4-Dinitro-phenylsulfanyl)-aziridine?
The CAS number of 1-(2,4-Dinitro-phenylsulfanyl)-aziridine is 7117-47-7.
What is the molecular formula of 1-(2,4-Dinitro-phenylsulfanyl)-aziridine?
The molecular formula of 1-(2,4-Dinitro-phenylsulfanyl)-aziridine is C8H7N3O4S.
What is the molecular weight of 1-(2,4-Dinitro-phenylsulfanyl)-aziridine?
The molecular weight of 1-(2,4-Dinitro-phenylsulfanyl)-aziridine is 241.02 g/mol.
Where can I buy 1-(2,4-Dinitro-phenylsulfanyl)-aziridine?
You can request a quote for 1-(2,4-Dinitro-phenylsulfanyl)-aziridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-Dinitro-phenylsulfanyl)-aziridine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dinitro-phenylsulfanyl)-aziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.