Butyl 4-(4-methyloxazole-5-carboxamido)benzoate
TL;DR: Butyl 4-(4-methyloxazole-5-carboxamido)benzoate (CAS 862828-94-2) is a chemical compound with molecular formula C16H18N2O4 and molecular weight 302.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 4-[(4-methyl-1,3-oxazole-5-carbonyl)amino]benzoate
Also Known As: butyl 4-(4-methyloxazole-5-carboxamido)benzoate, F0664-0062, butyl 4-[(4-methyl-1,3-oxazole-5-carbonyl)amino]benzoate, butyl 4-{[(4-methyl-1,3-oxazol-5-yl)carbonyl]amino}benzoate
| Molecular Formula | C16H18N2O4 |
|---|---|
| Molecular Weight | 302.13 g/mol |
| LogP | 3.19222 |
| Topological Polar Surface Area | 81.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 302.12665 |
| Heavy Atoms | 22 |
| Complexity | 646.42035 |
Chemical Identifiers
| CAS Number | 862828-94-2 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N=CO2)C |
Product Overview
Butyl 4-(4-methyloxazole-5-carboxamido)benzoate (CAS 862828-94-2), with molecular formula C16H18N2O4 and molecular weight 302.13 g/mol. IUPAC: butyl 4-[(4-methyl-1,3-oxazole-5-carbonyl)amino]benzoate.
Chemical Property Profile of Butyl 4-(4-methyloxazole-5-carboxamido)benzoate
Property Insights of Butyl 4-(4-methyloxazole-5-carboxamido)benzoate
The XLogP value of 3.19222 indicates that Butyl 4-(4-methyloxazole-5-carboxamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl 4-(4-methyloxazole-5-carboxamido)benzoate. Following Lipinski's Rule of Five, Butyl 4-(4-methyloxazole-5-carboxamido)benzoate has 1 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 Butyl 4-(4-methyloxazole-5-carboxamido)benzoate?
The CAS number of Butyl 4-(4-methyloxazole-5-carboxamido)benzoate is 862828-94-2.
What is the molecular formula of Butyl 4-(4-methyloxazole-5-carboxamido)benzoate?
The molecular formula of Butyl 4-(4-methyloxazole-5-carboxamido)benzoate is C16H18N2O4.
What is the molecular weight of Butyl 4-(4-methyloxazole-5-carboxamido)benzoate?
The molecular weight of Butyl 4-(4-methyloxazole-5-carboxamido)benzoate is 302.13 g/mol.
Where can I buy Butyl 4-(4-methyloxazole-5-carboxamido)benzoate?
You can request a quote for Butyl 4-(4-methyloxazole-5-carboxamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 4-(4-methyloxazole-5-carboxamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 4-(4-methyloxazole-5-carboxamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.