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(1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine structure
Fine Chemical

(1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine

TL;DR: (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine (CAS 1217780-32-9) is a chemical compound with molecular formula C11H13N3O and molecular weight 203.10587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(1S)-1-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]ethanamine

Also Known As: BAS 12533848, BB 0238878, (S)-1-(3-o-Tolyl-[1,2,4]oxadiazol-5-yl)-ethyla mine, (1S)-1-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]ethanamine, (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine

CAS Number
1217780-32-9
Molecular Formula
C11H13N3O
Molecular Weight
203.10587 g/mol
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Technical Specifications

Molecular FormulaC11H13N3O
Molecular Weight203.10587 g/mol
XLogP1.5
Topological Polar Surface Area (TPSA)64.9 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds2
Exact Mass203.10587 Da
Heavy Atoms15
Complexity212.0
SMILESCC1=CC=CC=C1C2=NOC(=N2)[C@H](C)N
InChIKeyQNDHHFVHVWUZQY-QMMMGPOBSA-N

Chemical Property Profile of (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine

XLogP
1.5
TPSA (Topological Polar Surface Area)
64.9
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
2
Heavy Atoms
15
Complexity
212.0
Exact Mass
203.10587
Monoisotopic Mass
203.10587
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 (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine

The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine. Following Lipinski's Rule of Five, (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine?

The CAS number of (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine is 1217780-32-9.

What is the molecular formula of (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine?

The molecular formula of (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine is C11H13N3O.

What is the molecular weight of (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine?

The molecular weight of (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine is 203.10587 g/mol.

Where can I buy (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine?

You can request a quote for (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine?

Yes, CoreyChem provides custom synthesis services for (1S)-1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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