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Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate
TL;DR: Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate (CAS 211102-69-1) is a chemical compound with molecular formula C13H14N2O2S and molecular weight 262.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate
Also Known As: methyl (2-benzylaminothiazol-4-yl)acetate, methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate, Methyl [2-(benzylamino)-1,3-thiazol-4-yl]acetate
| Molecular Formula | C13H14N2O2S |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 2.4707 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 262.0776 |
| Heavy Atoms | 18 |
| Complexity | 510.7196 |
Chemical Identifiers
| CAS Number | 211102-69-1 |
|---|---|
| SMILES | COC(=O)CC1=CSC(=N1)NCC2=CC=CC=C2 |
Product Overview
Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate (CAS 211102-69-1), with molecular formula C13H14N2O2S and molecular weight 262.08 g/mol. IUPAC: methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate.
Chemical Property Profile of Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate
Property Insights of Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate
The XLogP value of 2.4707 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate. With a topological polar surface area (TPSA) of 51.22 Ų, Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate 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 Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate?
The CAS number of Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate is 211102-69-1.
What is the molecular formula of Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate?
The molecular formula of Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate is C13H14N2O2S.
What is the molecular weight of Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate?
The molecular weight of Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate is 262.08 g/mol.
Where can I buy Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate?
You can request a quote for Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[2-(benzylamino)-1,3-thiazol-4-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.