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oxacillin structure
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oxacillin

TL;DR: oxacillin (CAS 66-79-5) is a chemical compound with molecular formula C19H19N3O5S and molecular weight 401.10455 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3,3-dimethyl-6-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Also Known As: oxacillin, MPI-penicillin; MPi-PC, BAS 01172378, Silicic acid (H4SiO4), tetraphenyl ester, 3,3-dimethyl-6-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

CAS Number
66-79-5
Molecular Formula
C19H19N3O5S
Molecular Weight
401.10455 g/mol
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Technical Specifications

Molecular FormulaC19H19N3O5S
Molecular Weight401.10455 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)138.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds4
Exact Mass401.10455 Da
Heavy Atoms28
Complexity680.0
SMILESCC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O
InChIKeyUWYHMGVUTGAWSP-UHFFFAOYSA-N

Product Description

Applications: oxacillin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies oxacillin (CAS 66-79-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

oxacillin is a fine chemical identified by CAS number 66-79-5 and the molecular formula C19H19N3O5S and a molecular weight of 401.1 g/mol. It is also known as oxacillin and MPI-penicillin.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of oxacillin

XLogP
2.4
TPSA (Topological Polar Surface Area)
138.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
4
Heavy Atoms
28
Complexity
680.0
Exact Mass
401.10455
Monoisotopic Mass
401.10455
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 oxacillin

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for oxacillin. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for oxacillin. Following Lipinski's Rule of Five, oxacillin has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of oxacillin?

The CAS number of oxacillin is 66-79-5.

What is the molecular formula of oxacillin?

The molecular formula of oxacillin is C19H19N3O5S.

What is the molecular weight of oxacillin?

The molecular weight of oxacillin is 401.10455 g/mol.

What are the applications of oxacillin?

oxacillin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies oxacillin (CAS 66-79-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Where can I buy oxacillin?

You can request a quote for oxacillin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for oxacillin?

Yes, CoreyChem provides custom synthesis services for oxacillin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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