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2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid structure
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2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid

TL;DR: 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid (CAS 1212192-43-2) is a chemical compound with molecular formula C20H19N3O6 and molecular weight 397.12738 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic acid

Also Known As: 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid, (S)-2-(5-((2,4-dimethylphenyl)carbamoyl)-3-(4-nitrophenyl)-4,5-dihydroisoxazol-5-yl)acetic acid, [(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid

CAS Number
1212192-43-2
Molecular Formula
C20H19N3O6
Molecular Weight
397.12738 g/mol
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Technical Specifications

Molecular FormulaC20H19N3O6
Molecular Weight397.12738 g/mol
XLogP2.6
Topological Polar Surface Area (TPSA)134.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds5
Exact Mass397.12738 Da
Heavy Atoms29
Complexity682.0
SMILESCC1=CC(=C(C=C1)NC(=O)[C@]2(CC(=NO2)C3=CC=C(C=C3)[N+](=O)[O-])CC(=O)O)C
InChIKeyHDGXKZMOXTWWBI-FQEVSTJZSA-N

Chemical Property Profile of 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid

XLogP
2.6
TPSA (Topological Polar Surface Area)
134.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
5
Heavy Atoms
29
Complexity
682.0
Exact Mass
397.12738
Monoisotopic Mass
397.12738
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-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid

The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid. Following Lipinski's Rule of Five, 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid 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 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid?

The CAS number of 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid is 1212192-43-2.

What is the molecular formula of 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid?

The molecular formula of 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid is C20H19N3O6.

What is the molecular weight of 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid?

The molecular weight of 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid is 397.12738 g/mol.

Where can I buy 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid?

You can request a quote for 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid?

Yes, CoreyChem provides custom synthesis services for 2-[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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