![[(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate structure](/static/products/6057/6057-40-5.webp)
[(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate
TL;DR: [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate (CAS 6057-40-5) is a chemical compound with molecular formula C16H11ClN2O3 and molecular weight 314.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate
Also Known As: Narcotine, picrolonate, (.+.)-, [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate, BIM-0020705.P001, 1-methyl-1H-indole-2,3-dione 3-[O-(4-chlorobenzoyl)oxime], (3E)-1-Methyl-1H-indole-2,3-dione 3-[O-(4-chlorobenzoyl)oxime] #
| Molecular Formula | C16H11ClN2O3 |
|---|---|
| Molecular Weight | 314.05 g/mol |
| LogP | 2.8775 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.0458 |
| Heavy Atoms | 22 |
| Complexity | 784.23285 |
Chemical Identifiers
| CAS Number | 6057-40-5 |
|---|---|
| SMILES | CN1C2=CC=CC=C2/C(=N\OC(=O)C3=CC=C(C=C3)Cl)/C1=O |
Product Overview
[(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate (CAS 6057-40-5), with molecular formula C16H11ClN2O3 and molecular weight 314.05 g/mol. IUPAC: [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate.
Chemical Property Profile of [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate
Property Insights of [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate
The XLogP value of 2.8775 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate. With a topological polar surface area (TPSA) of 58.97 Ų, [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate has 0 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 [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate?
The CAS number of [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate is 6057-40-5.
What is the molecular formula of [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate?
The molecular formula of [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate is C16H11ClN2O3.
What is the molecular weight of [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate?
The molecular weight of [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate is 314.05 g/mol.
Where can I buy [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate?
You can request a quote for [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(E)-(1-methyl-2-oxoindol-3-ylidene)amino] 4-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.