![5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile structure](/static/products/613/613649-80-2.png)
5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile
TL;DR: 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile (CAS 613649-80-2) is a chemical compound with molecular formula C15H17N5O3 and molecular weight 315.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-(dimethylamino)propylamino]-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile
Also Known As: AB01288141-01, 5-{[3-(dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile, 5-((3-(dimethylamino)propyl)amino)-2-(4-nitrophenyl)oxazole-4-carbonitrile, 5-(3-dimethylamino-propylamino)-2-(4-nitro-phenyl)-oxazole-4-carbonitrile, 5-(3-dimethylaminopropylamino)-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile
| Molecular Formula | C15H17N5O3 |
|---|---|
| Molecular Weight | 315.13 g/mol |
| LogP | 2.48508 |
| Topological Polar Surface Area | 108.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 315.13315 |
| Heavy Atoms | 23 |
| Complexity | 715.70386 |
Chemical Identifiers
| CAS Number | 613649-80-2 |
|---|---|
| SMILES | CN(C)CCCNC1=C(N=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C#N |
Product Overview
5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile (CAS 613649-80-2), with molecular formula C15H17N5O3 and molecular weight 315.13 g/mol. IUPAC: 5-[3-(dimethylamino)propylamino]-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile
Property Insights of 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile
The XLogP value of 2.48508 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile. The TPSA of 108.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile has 1 hydrogen bond donor(s) and 7 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-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile?
The CAS number of 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile is 613649-80-2.
What is the molecular formula of 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile?
The molecular formula of 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile is C15H17N5O3.
What is the molecular weight of 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile?
The molecular weight of 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile is 315.13 g/mol.
Where can I buy 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile?
You can request a quote for 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-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-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-{[3-(Dimethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.