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N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline structure
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N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline

TL;DR: N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline (CAS 127753-24-6) is a chemical compound with molecular formula C16H16N2O and molecular weight 252.12627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N,N-dimethyl-4-(5-methyl-1,3-benzoxazol-2-yl)aniline

Also Known As: N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline, N,N-dimethyl-4-(5-methyl-1,3-benzoxazol-2-yl)aniline, 5-Methyl-2-[4-(dimethylamino)phenyl]benzoxazole, 4-(5-methylbenzo[d]oxazol-2-yl)-N,N-dimethylaniline, Dimethyl-[4-(5-methyl-benzooxazol-2-yl)-phenyl]-amine

CAS Number
127753-24-6
Molecular Formula
C16H16N2O
Molecular Weight
252.12627 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (5 patents) Pharmaceutical Intermediates (4 patents)

Technical Specifications

Molecular FormulaC16H16N2O
Molecular Weight252.12627 g/mol
XLogP3.9
Topological Polar Surface Area (TPSA)29.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass252.12627 Da
Heavy Atoms19
Complexity299.0
SMILESCC1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)N(C)C
InChIKeyGWQQMDXJIKVKNB-UHFFFAOYSA-N

Chemical Property Profile of N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline

XLogP
3.9
TPSA (Topological Polar Surface Area)
29.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
19
Complexity
299.0
Exact Mass
252.12627
Monoisotopic Mass
252.12627
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 N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline

The XLogP value of 3.9 indicates that N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.3 Ų, N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline?

The CAS number of N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline is 127753-24-6.

What is the molecular formula of N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline?

The molecular formula of N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline is C16H16N2O.

What is the molecular weight of N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline?

The molecular weight of N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline is 252.12627 g/mol.

Where can I buy N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline?

You can request a quote for N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline?

Yes, CoreyChem provides custom synthesis services for N,N-Dimethyl-4-(5-methylbenzo[d]oxazol-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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