![[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate structure](/static/products/853/853570-61-3.png)
[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate
TL;DR: [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate (CAS 853570-61-3) is a chemical compound with molecular formula C21H20N4O4S and molecular weight 424.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate
Also Known As: [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate|{2-[2-(2-Methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl}methyl 4-(carbamoylamino)benzoate|MLS002245655|SMR001309299
| Molecular Formula | C21H20N4O4S |
|---|---|
| Molecular Weight | 424.12 g/mol |
| LogP | 3.48032 |
| Topological Polar Surface Area | 123.41 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.1205 |
| Heavy Atoms | 30 |
| Complexity | 1062.8782 |
Chemical Identifiers
| CAS Number | 853570-61-3 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)COC(=O)C3=CC=C(C=C3)NC(=O)N |
Product Overview
[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate (CAS 853570-61-3), with molecular formula C21H20N4O4S and molecular weight 424.12 g/mol. IUPAC: [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate.
Chemical Property Profile of [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate
Property Insights of [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate
The XLogP value of 3.48032 indicates that [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.41 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate. Following Lipinski's Rule of Five, [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate has 3 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 [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate?
The CAS number of [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate is 853570-61-3.
What is the molecular formula of [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate?
The molecular formula of [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate is C21H20N4O4S.
What is the molecular weight of [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate?
The molecular weight of [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate is 424.12 g/mol.
Where can I buy [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate?
You can request a quote for [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-(carbamoylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.