![2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole structure](/static/products/4059/405920-32-3.webp)
2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole
TL;DR: 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole (CAS 405920-32-3) is a chemical compound with molecular formula C17H14N2O5S2 and molecular weight 390.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(benzenesulfonyl)-2-methyl-5-[(4-nitrophenyl)methylsulfanyl]-1,3-oxazole
Also Known As: AB00112704-01, 2-methyl-5-((4-nitrobenzyl)thio)-4-(phenylsulfonyl)oxazole, 2-methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole, 4-(benzenesulfonyl)-2-methyl-5-[(4-nitrophenyl)methylsulfanyl]-1,3-oxazole
| Molecular Formula | C17H14N2O5S2 |
|---|---|
| Molecular Weight | 390.03 g/mol |
| LogP | 4.01632 |
| Topological Polar Surface Area | 103.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.03442 |
| Heavy Atoms | 26 |
| Complexity | 1028.775 |
Chemical Identifiers
| CAS Number | 405920-32-3 |
|---|---|
| SMILES | CC1=NC(=C(O1)SCC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3 |
Product Overview
2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole (CAS 405920-32-3), with molecular formula C17H14N2O5S2 and molecular weight 390.03 g/mol. IUPAC: 4-(benzenesulfonyl)-2-methyl-5-[(4-nitrophenyl)methylsulfanyl]-1,3-oxazole.
Chemical Property Profile of 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole
Property Insights of 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole
The XLogP value of 4.01632 indicates that 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole. Following Lipinski's Rule of Five, 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole has 0 hydrogen bond donor(s) and 7 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-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole?
The CAS number of 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole is 405920-32-3.
What is the molecular formula of 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole?
The molecular formula of 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole is C17H14N2O5S2.
What is the molecular weight of 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole?
The molecular weight of 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole is 390.03 g/mol.
Where can I buy 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole?
You can request a quote for 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-5-[(4-nitrobenzyl)sulfanyl]-4-(phenylsulfonyl)-1,3-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.