2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate
TL;DR: 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate (CAS 380567-83-9) is a chemical compound with molecular formula C14H13NO3S and molecular weight 275.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-anilino-2-oxoethyl) 3-methylthiophene-2-carboxylate
Also Known As: starbld0005312, 2-oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate, (phenylcarbamoyl)methyl 3-methylthiophene-2-carboxylate, (2-anilino-2-oxoethyl) 3-methylthiophene-2-carboxylate, F6609-3933
| Molecular Formula | C14H13NO3S |
|---|---|
| Molecular Weight | 275.06 g/mol |
| LogP | 2.85202 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.0616 |
| Heavy Atoms | 19 |
| Complexity | 577.38684 |
Chemical Identifiers
| CAS Number | 380567-83-9 |
|---|---|
| SMILES | CC1=C(SC=C1)C(=O)OCC(=O)NC2=CC=CC=C2 |
Product Overview
2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate (CAS 380567-83-9), with molecular formula C14H13NO3S and molecular weight 275.06 g/mol. IUPAC: (2-anilino-2-oxoethyl) 3-methylthiophene-2-carboxylate.
Chemical Property Profile of 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate
Property Insights of 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate
The XLogP value of 2.85202 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate. With a topological polar surface area (TPSA) of 55.4 Ų, 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate has 1 hydrogen bond donor(s) and 4 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-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate?
The CAS number of 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate is 380567-83-9.
What is the molecular formula of 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate?
The molecular formula of 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate is C14H13NO3S.
What is the molecular weight of 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate?
The molecular weight of 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate is 275.06 g/mol.
Where can I buy 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate?
You can request a quote for 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-2-(phenylamino)ethyl 3-methylthiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.