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

TL;DR: 2-[(5S)-5-(cycloheptylcarbamoyl)-3-(3-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid (CAS 1212089-68-3) is a chemical compound with molecular formula C19H23N3O6 and molecular weight 389.1587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

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

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

CAS Number
1212089-68-3
Molecular Formula
C19H23N3O6
Molecular Weight
389.1587 g/mol
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Technical Specifications

Molecular FormulaC19H23N3O6
Molecular Weight389.1587 g/mol
XLogP2.7
Topological Polar Surface Area (TPSA)134.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds5
Exact Mass389.1587 Da
Heavy Atoms28
Complexity638.0
SMILESC1CCCC(CC1)NC(=O)[C@]2(CC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-])CC(=O)O
InChIKeyJUNVQALRXLAYLY-IBGZPJMESA-N

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

XLogP
2.7
TPSA (Topological Polar Surface Area)
134.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
5
Heavy Atoms
28
Complexity
638.0
Exact Mass
389.1587
Monoisotopic Mass
389.1587
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-(cycloheptylcarbamoyl)-3-(3-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid

The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5S)-5-(cycloheptylcarbamoyl)-3-(3-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-(cycloheptylcarbamoyl)-3-(3-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid. Following Lipinski's Rule of Five, 2-[(5S)-5-(cycloheptylcarbamoyl)-3-(3-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-(cycloheptylcarbamoyl)-3-(3-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid?

The CAS number of 2-[(5S)-5-(cycloheptylcarbamoyl)-3-(3-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid is 1212089-68-3.

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

The molecular formula of 2-[(5S)-5-(cycloheptylcarbamoyl)-3-(3-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid is C19H23N3O6.

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

The molecular weight of 2-[(5S)-5-(cycloheptylcarbamoyl)-3-(3-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid is 389.1587 g/mol.

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

You can request a quote for 2-[(5S)-5-(cycloheptylcarbamoyl)-3-(3-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-(cycloheptylcarbamoyl)-3-(3-nitrophenyl)-4H-1,2-oxazol-5-yl]acetic Acid?

Yes, CoreyChem provides custom synthesis services for 2-[(5S)-5-(cycloheptylcarbamoyl)-3-(3-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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