2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-
TL;DR: 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)- (CAS 65387-40-8) is a chemical compound with molecular formula C16H13NO3 and molecular weight 267.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-anilino-4-oxo-4-phenylbut-2-enoic acid
Also Known As: 2-anilino-4-oxo-4-phenylbut-2-enoic acid, 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-, 2-anilino-4-oxo-4-phenyl-crotonic acid, BAS 01029555
| Molecular Formula | C16H13NO3 |
|---|---|
| Molecular Weight | 267.09 g/mol |
| LogP | 2.9499 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 267.08954 |
| Heavy Atoms | 20 |
| Complexity | 633.28625 |
Chemical Identifiers
| CAS Number | 65387-40-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C=C(C(=O)O)NC2=CC=CC=C2 |
Product Overview
2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)- (CAS 65387-40-8), with molecular formula C16H13NO3 and molecular weight 267.09 g/mol. IUPAC: 2-anilino-4-oxo-4-phenylbut-2-enoic acid.
Chemical Property Profile of 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-
Property Insights of 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-
The XLogP value of 2.9499 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-. Following Lipinski's Rule of Five, 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)- has 2 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 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-?
The CAS number of 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)- is 65387-40-8.
What is the molecular formula of 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-?
The molecular formula of 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)- is C16H13NO3.
What is the molecular weight of 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-?
The molecular weight of 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)- is 267.09 g/mol.
Where can I buy 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-?
You can request a quote for 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenoic acid, 4-oxo-4-phenyl-2-(phenylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.