Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate
TL;DR: Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate (CAS 852400-27-2) is a chemical compound with molecular formula C12H20N2O2S and molecular weight 256.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate
Also Known As: ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate, Ethyl 4-methyl-2-(pentylamino)thiazole-5-carboxylate, Ethyl4-methyl-2-(pentylamino)thiazole-5-carboxylate, 5-Thiazolecarboxylic acid, 4-methyl-2-(pentylamino)-, ethyl ester
| Molecular Formula | C12H20N2O2S |
|---|---|
| Molecular Weight | 256.12 g/mol |
| LogP | 3.23032 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 256.12454 |
| Heavy Atoms | 17 |
| Complexity | 363.38763 |
Chemical Identifiers
| CAS Number | 852400-27-2 |
|---|---|
| SMILES | CCCCCNC1=NC(=C(S1)C(=O)OCC)C |
Product Overview
Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate (CAS 852400-27-2), with molecular formula C12H20N2O2S and molecular weight 256.12 g/mol. IUPAC: ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate.
Chemical Property Profile of Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate
Property Insights of Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate
The XLogP value of 3.23032 indicates that Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate 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 Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate?
The CAS number of Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate is 852400-27-2.
What is the molecular formula of Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate?
The molecular formula of Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate is C12H20N2O2S.
What is the molecular weight of Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate?
The molecular weight of Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate is 256.12 g/mol.
Where can I buy Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate?
You can request a quote for Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.