Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate
TL;DR: Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate (CAS 144333-90-4) is a chemical compound with molecular formula C18H16N2O3 and molecular weight 308.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate
Also Known As: 2-Butenedioic acid(2Z)-, monomethyl ester, (diphenylmethylene)hydrazide (9CI), 2-Butenedioic acid (Z)-, monomethyl ester, (diphenylmethylene)hydrazide
| Molecular Formula | C18H16N2O3 |
|---|---|
| Molecular Weight | 308.12 g/mol |
| LogP | 2.2844 |
| Topological Polar Surface Area | 67.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.1161 |
| Heavy Atoms | 23 |
| Complexity | 680.9466 |
Chemical Identifiers
| CAS Number | 144333-90-4 |
|---|---|
| SMILES | COC(=O)C=CC(=O)NN=C(C1=CC=CC=C1)C2=CC=CC=C2 |
Product Overview
Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate (CAS 144333-90-4), with molecular formula C18H16N2O3 and molecular weight 308.12 g/mol. IUPAC: methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate.
Chemical Property Profile of Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate
Property Insights of Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate
The XLogP value of 2.2844 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate. The TPSA of 67.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate. Following Lipinski's Rule of Five, Methyl 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 Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate?
The CAS number of Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate is 144333-90-4.
What is the molecular formula of Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate?
The molecular formula of Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate is C18H16N2O3.
What is the molecular weight of Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate?
The molecular weight of Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate is 308.12 g/mol.
Where can I buy Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate?
You can request a quote for Methyl 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 Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.