Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate
TL;DR: Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate (CAS 160282-30-4) is a chemical compound with molecular formula C19H18N2O3 and molecular weight 322.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate
Also Known As: 2-Butenedioic acid (Z)-, monoethyl ester, (diphenylmethylene)hydrazide, 2-Butenedioic acid(2Z)-, monoethyl ester, (diphenylmethylene)hydrazide (9CI)
| Molecular Formula | C19H18N2O3 |
|---|---|
| Molecular Weight | 322.13 g/mol |
| LogP | 2.6745 |
| Topological Polar Surface Area | 67.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 322.13174 |
| Heavy Atoms | 24 |
| Complexity | 696.2219 |
Chemical Identifiers
| CAS Number | 160282-30-4 |
|---|---|
| SMILES | CCOC(=O)C=CC(=O)NN=C(C1=CC=CC=C1)C2=CC=CC=C2 |
Product Overview
Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate (CAS 160282-30-4), with molecular formula C19H18N2O3 and molecular weight 322.13 g/mol. IUPAC: ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate.
Chemical Property Profile of Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate
Property Insights of Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate
The XLogP value of 2.6745 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate. The TPSA of 67.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate. Following Lipinski's Rule of Five, Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate 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 Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate?
The CAS number of Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate is 160282-30-4.
What is the molecular formula of Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate?
The molecular formula of Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate is C19H18N2O3.
What is the molecular weight of Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate?
The molecular weight of Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate is 322.13 g/mol.
Where can I buy Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate?
You can request a quote for Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.