(3Z)-3-(1-anilinoethylidene)oxolan-2-one
TL;DR: (3Z)-3-(1-anilinoethylidene)oxolan-2-one (CAS 14197-51-4) 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.
(3Z)-3-(1-anilinoethylidene)oxolan-2-one
Also Known As: 3-(1-anilinoethylidene)oxolan-2-one, (3Z)-3-(1-anilinoethylidene)oxolan-2-one, 1-Pyrrolidinehexanoic acid,3-mercapto-2,5-dioxo, 3-[1-(phenylamino)ethylidene]dihydrofuran-2(3H)-one
| Molecular Formula | C12H13NO2 |
|---|---|
| Molecular Weight | 203.09 g/mol |
| LogP | 2.3194 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.09464 |
| Heavy Atoms | 15 |
| Complexity | 395.34296 |
Chemical Identifiers
| CAS Number | 14197-51-4 |
|---|---|
| SMILES | C/C(=C/1\CCOC1=O)/NC2=CC=CC=C2 |
Product Overview
(3Z)-3-(1-anilinoethylidene)oxolan-2-one (CAS 14197-51-4), with molecular formula C12H13NO2 and molecular weight 203.09 g/mol. IUPAC: (3Z)-3-(1-anilinoethylidene)oxolan-2-one.
Chemical Property Profile of (3Z)-3-(1-anilinoethylidene)oxolan-2-one
Property Insights of (3Z)-3-(1-anilinoethylidene)oxolan-2-one
The XLogP value of 2.3194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3Z)-3-(1-anilinoethylidene)oxolan-2-one. With a topological polar surface area (TPSA) of 38.33 Ų, (3Z)-3-(1-anilinoethylidene)oxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3Z)-3-(1-anilinoethylidene)oxolan-2-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 (3Z)-3-(1-anilinoethylidene)oxolan-2-one?
The CAS number of (3Z)-3-(1-anilinoethylidene)oxolan-2-one is 14197-51-4.
What is the molecular formula of (3Z)-3-(1-anilinoethylidene)oxolan-2-one?
The molecular formula of (3Z)-3-(1-anilinoethylidene)oxolan-2-one is C12H13NO2.
What is the molecular weight of (3Z)-3-(1-anilinoethylidene)oxolan-2-one?
The molecular weight of (3Z)-3-(1-anilinoethylidene)oxolan-2-one is 203.09 g/mol.
Where can I buy (3Z)-3-(1-anilinoethylidene)oxolan-2-one?
You can request a quote for (3Z)-3-(1-anilinoethylidene)oxolan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3Z)-3-(1-anilinoethylidene)oxolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3Z)-3-(1-anilinoethylidene)oxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.