(5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate
TL;DR: (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate (CAS 7462-52-4) is a chemical compound with molecular formula C18H19NO4S and molecular weight 345.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate
Also Known As: (5-methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate, (5-methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-meth, (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzene-1-sulfonate
| Molecular Formula | C18H19NO4S |
|---|---|
| Molecular Weight | 345.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 73.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.1035 |
| Heavy Atoms | 24 |
| Complexity | 540.0 |
Chemical Identifiers
| CAS Number | 7462-52-4 |
|---|---|
| SMILES | CC1C(N=C(O1)C2=CC=CC=C2)COS(=O)(=O)C3=CC=C(C=C3)C |
| InChIKey | GOJBJDNOKQXAIQ-UHFFFAOYSA-N |
Product Overview
(5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate (CAS 7462-52-4), with molecular formula C18H19NO4S and molecular weight 345.10 g/mol. IUPAC: (5-methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate.
Chemical Property Profile of (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate
Property Insights of (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate
The XLogP value of 3.3 indicates that (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate 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 (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate?
The CAS number of (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate is 7462-52-4.
What is the molecular formula of (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate?
The molecular formula of (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate is C18H19NO4S.
What is the molecular weight of (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate?
The molecular weight of (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate is 345.10 g/mol.
Where can I buy (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate?
You can request a quote for (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (5-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.