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Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate
TL;DR: Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate (CAS 318517-58-7) is a chemical compound with molecular formula C12H12Cl2N2O4 and molecular weight 318.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2,4-dichlorobenzoyl)amino]-3-methoxyiminopropanoate
Also Known As: methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate, methyl 2-[(2,4-dichlorobenzoyl)amino]-3-methoxyiminopropanoate, Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-methoxyimino-propanoate, methyl (3E)-2-[(2,4-dichlorobenzoyl)amino]-3-methoxyiminopropanoate
| Molecular Formula | C12H12Cl2N2O4 |
|---|---|
| Molecular Weight | 318.02 g/mol |
| LogP | 1.897 |
| Topological Polar Surface Area | 76.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.01743 |
| Heavy Atoms | 20 |
| Complexity | 534.18866 |
Chemical Identifiers
| CAS Number | 318517-58-7 |
|---|---|
| SMILES | COC(=O)C(C=NOC)NC(=O)C1=C(C=C(C=C1)Cl)Cl |
Product Overview
Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate (CAS 318517-58-7), with molecular formula C12H12Cl2N2O4 and molecular weight 318.02 g/mol. IUPAC: methyl 2-[(2,4-dichlorobenzoyl)amino]-3-methoxyiminopropanoate.
Chemical Property Profile of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate
Property Insights of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate
The XLogP value of 1.897 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate. The TPSA of 76.99 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate. Following Lipinski's Rule of Five, Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate 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 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate?
The CAS number of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate is 318517-58-7.
What is the molecular formula of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate?
The molecular formula of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate is C12H12Cl2N2O4.
What is the molecular weight of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate?
The molecular weight of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate is 318.02 g/mol.
Where can I buy Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate?
You can request a quote for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3-(methoxyimino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.