3-Ethyl-4-(phenylamino)furan-2(5H)-one
TL;DR: 3-Ethyl-4-(phenylamino)furan-2(5H)-one (CAS 501653-19-6) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-anilino-4-ethyl-2H-furan-5-one
Also Known As: 3-anilino-4-ethyl-2H-furan-5-one, 3-Ethyl-4-(phenylamino)furan-2(5H)-one, 2(5H)-Furanone,3-ethyl-4-(phenylamino)-(9ci), 2(5H)-FURANONE, 3-ETHYL-4-(PHENYLAMINO)-, 2(5H)-Furanone, 3-ethyl-4-(phenylamino)- (9CI)
| Molecular Formula | C12H13NO2 |
|---|---|
| Molecular Weight | 203.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.09464 |
| Heavy Atoms | 15 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 501653-19-6 |
|---|---|
| SMILES | CCC1=C(COC1=O)NC2=CC=CC=C2 |
| InChIKey | VNSQOUUSEQNNBZ-UHFFFAOYSA-N |
Product Overview
3-Ethyl-4-(phenylamino)furan-2(5H)-one (CAS 501653-19-6), with molecular formula C12H13NO2 and molecular weight 203.09 g/mol. IUPAC: 3-anilino-4-ethyl-2H-furan-5-one.
Chemical Property Profile of 3-Ethyl-4-(phenylamino)furan-2(5H)-one
Property Insights of 3-Ethyl-4-(phenylamino)furan-2(5H)-one
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethyl-4-(phenylamino)furan-2(5H)-one. With a topological polar surface area (TPSA) of 38.3 Ų, 3-Ethyl-4-(phenylamino)furan-2(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethyl-4-(phenylamino)furan-2(5H)-one has 1 hydrogen bond donor(s) and 3 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 3-Ethyl-4-(phenylamino)furan-2(5H)-one?
The CAS number of 3-Ethyl-4-(phenylamino)furan-2(5H)-one is 501653-19-6.
What is the molecular formula of 3-Ethyl-4-(phenylamino)furan-2(5H)-one?
The molecular formula of 3-Ethyl-4-(phenylamino)furan-2(5H)-one is C12H13NO2.
What is the molecular weight of 3-Ethyl-4-(phenylamino)furan-2(5H)-one?
The molecular weight of 3-Ethyl-4-(phenylamino)furan-2(5H)-one is 203.09 g/mol.
Where can I buy 3-Ethyl-4-(phenylamino)furan-2(5H)-one?
You can request a quote for 3-Ethyl-4-(phenylamino)furan-2(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-4-(phenylamino)furan-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-4-(phenylamino)furan-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.