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2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate structure
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2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate

TL;DR: 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate (CAS 1396971-90-6) is a chemical compound with molecular formula C18H13F4NO5 and molecular weight 399.073 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl] 2,6-difluorobenzoate

Also Known As: 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate, 7K-907, l-Serine, N,o-bis-(2,6-difluorobenzoyl)-, methyl ester, methyl 3-(2,6-difluorobenzoyloxy)-2-[(2,6-difluorophenyl)formamido]propanoate, [2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl] 2,6-difluorobenzoate

CAS Number
1396971-90-6
Molecular Formula
C18H13F4NO5
Molecular Weight
399.073 g/mol
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Technical Specifications

Molecular FormulaC18H13F4NO5
Molecular Weight399.073 g/mol
XLogP3.1
Topological Polar Surface Area (TPSA)81.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors9
Rotatable Bonds8
Exact Mass399.073 Da
Heavy Atoms28
Complexity558.0
SMILESCOC(=O)C(COC(=O)C1=C(C=CC=C1F)F)NC(=O)C2=C(C=CC=C2F)F
InChIKeyFKFQYFNFXJNQEB-UHFFFAOYSA-N

Chemical Property Profile of 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate

XLogP
3.1
TPSA (Topological Polar Surface Area)
81.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
9
Rotatable Bonds
8
Heavy Atoms
28
Complexity
558.0
Exact Mass
399.073
Monoisotopic Mass
399.073
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate

The XLogP value of 3.1 indicates that 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate. Following Lipinski's Rule of Five, 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate?

The CAS number of 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate is 1396971-90-6.

What is the molecular formula of 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate?

The molecular formula of 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate is C18H13F4NO5.

What is the molecular weight of 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate?

The molecular weight of 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate is 399.073 g/mol.

Where can I buy 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate?

You can request a quote for 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate?

Yes, CoreyChem provides custom synthesis services for 2-[(2,6-difluorobenzoyl)amino]-3-methoxy-3-oxopropyl 2,6-difluorobenzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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