![5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile structure](/static/products/846/846582-79-4.png)
5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile
TL;DR: 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile (CAS 846582-79-4) is a chemical compound with molecular formula C17H15N3O and molecular weight 277.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-naphthalen-1-yl-5-(propan-2-ylamino)-1,3-oxazole-4-carbonitrile
Also Known As: 5-(isopropylamino)-2-(naphthalen-1-yl)oxazole-4-carbonitrile, 5-[(methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile, 2-naphthalen-1-yl-5-(propan-2-ylamino)-1,3-oxazole-4-carbonitrile, 2-(naphthalen-1-yl)-5-(propan-2-ylamino)-1,3-oxazole-4-carbonitrile
| Molecular Formula | C17H15N3O |
|---|---|
| Molecular Weight | 277.12 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 61.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.12152 |
| Heavy Atoms | 21 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 846582-79-4 |
|---|---|
| SMILES | CC(C)NC1=C(N=C(O1)C2=CC=CC3=CC=CC=C32)C#N |
| InChIKey | RGSLYFVYRJABDN-UHFFFAOYSA-N |
Product Overview
5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile (CAS 846582-79-4), with molecular formula C17H15N3O and molecular weight 277.12 g/mol. IUPAC: 2-naphthalen-1-yl-5-(propan-2-ylamino)-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile
Property Insights of 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile
The XLogP value of 5.0 indicates that 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile 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
Frequently Asked Questions
What is the CAS number of 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile?
The CAS number of 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile is 846582-79-4.
What is the molecular formula of 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile?
The molecular formula of 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile is C17H15N3O.
What is the molecular weight of 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile?
The molecular weight of 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile is 277.12 g/mol.
Where can I buy 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile?
You can request a quote for 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-[(Methylethyl)amino]-2-naphthyl-1,3-oxazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.