Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate
TL;DR: Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate (CAS 477551-58-9) is a chemical compound with molecular formula C22H22N2O4S and molecular weight 410.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[2-[(3-butoxybenzoyl)amino]-1,3-thiazol-4-yl]benzoate
Also Known As: methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate, F0882-0135, methyl 4-[2-(3-butoxybenzamido)-1,3-thiazol-4-yl]benzoate, Methyl 4-[2-[(3-butoxybenzoyl)amino]-1,3-thiazol-4-yl]benzoate, methyl p-[2-(m-butoxybenzylamino)-1,3-thiazol-4-yl]benzoate
| Molecular Formula | C22H22N2O4S |
|---|---|
| Molecular Weight | 410.13 g/mol |
| LogP | 5.0279 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 410.13004 |
| Heavy Atoms | 29 |
| Complexity | 982.4872 |
Chemical Identifiers
| CAS Number | 477551-58-9 |
|---|---|
| SMILES | CCCCOC1=CC=CC(=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C(=O)OC |
Product Overview
Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate (CAS 477551-58-9), with molecular formula C22H22N2O4S and molecular weight 410.13 g/mol. IUPAC: methyl 4-[2-[(3-butoxybenzoyl)amino]-1,3-thiazol-4-yl]benzoate.
Chemical Property Profile of Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate
Property Insights of Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate
The XLogP value of 5.0279 indicates that Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate. Following Lipinski's Rule of Five, Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate?
The CAS number of Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate is 477551-58-9.
What is the molecular formula of Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate?
The molecular formula of Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate is C22H22N2O4S.
What is the molecular weight of Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate?
The molecular weight of Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate is 410.13 g/mol.
Where can I buy Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate?
You can request a quote for Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(2-(3-butoxybenzamido)thiazol-4-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.