![methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate structure](/static/products/374/374099-52-2.png)
methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate
TL;DR: methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate (CAS 374099-52-2) is a chemical compound with molecular formula C11H11ClN2O4 and molecular weight 270.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[(Z)-1-chloroethylideneamino]oxycarbonylamino]benzoate
Also Known As: Methyl 4-[(1-chloroethylideneamino)oxycarbonylamino]benzoate, (Z)-methyl 4-(((((1-chloroethylidene)amino)oxy)carbonyl)amino)benzoate, methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate
| Molecular Formula | C11H11ClN2O4 |
|---|---|
| Molecular Weight | 270.04 g/mol |
| LogP | 2.5939 |
| Topological Polar Surface Area | 76.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.04074 |
| Heavy Atoms | 18 |
| Complexity | 466.4365 |
Chemical Identifiers
| CAS Number | 374099-52-2 |
|---|---|
| SMILES | C/C(=N/OC(=O)NC1=CC=C(C=C1)C(=O)OC)/Cl |
Product Overview
methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate (CAS 374099-52-2), with molecular formula C11H11ClN2O4 and molecular weight 270.04 g/mol. IUPAC: methyl 4-[[(Z)-1-chloroethylideneamino]oxycarbonylamino]benzoate.
Chemical Property Profile of methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate
Property Insights of methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate
The XLogP value of 2.5939 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate. The TPSA of 76.99 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate. Following Lipinski's Rule of Five, methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate has 1 hydrogen bond donor(s) and 5 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-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate?
The CAS number of methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate is 374099-52-2.
What is the molecular formula of methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate?
The molecular formula of methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate is C11H11ClN2O4.
What is the molecular weight of methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate?
The molecular weight of methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate is 270.04 g/mol.
Where can I buy methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate?
You can request a quote for methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-{[({[(1Z)-1-chloroethylidene]amino}oxy)carbonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.