Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate
TL;DR: Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate (CAS 69123-48-4) is a chemical compound with molecular formula C13H15N3O3S and molecular weight 293.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate
Also Known As: ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate, ETHYL 4-{[(4,5-DIHYDRO-1,3-THIAZOL-2-YL)CARBAMOYL]AMINO}BENZOATE
| Molecular Formula | C13H15N3O3S |
|---|---|
| Molecular Weight | 293.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.0834 |
| Heavy Atoms | 20 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 69123-48-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=NCCS2 |
| InChIKey | MHLLHTZJLCRFCU-UHFFFAOYSA-N |
Product Overview
Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate (CAS 69123-48-4), with molecular formula C13H15N3O3S and molecular weight 293.08 g/mol. IUPAC: ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate.
Chemical Property Profile of Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate
Property Insights of Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate. Following Lipinski's Rule of Five, Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate has 2 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 Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate?
The CAS number of Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate is 69123-48-4.
What is the molecular formula of Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate?
The molecular formula of Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate is C13H15N3O3S.
What is the molecular weight of Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate?
The molecular weight of Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate is 293.08 g/mol.
Where can I buy Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate?
You can request a quote for Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(4,5-dihydro-1,3-thiazol-2-ylcarbamoylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.