![2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile structure](/static/products/848/848741-90-2.png)
2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile
TL;DR: 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile (CAS 848741-90-2) is a chemical compound with molecular formula C23H21N5O2 and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-imidazol-1-ylpropylamino)-2-(4-phenylmethoxyphenyl)-1,3-oxazole-4-carbonitrile
Also Known As: 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile, 5-((3-(1H-imidazol-1-yl)propyl)amino)-2-(4-(benzyloxy)phenyl)oxazole-4-carbonitrile, 5-(3-imidazol-1-ylpropylamino)-2-(4-phenylmethoxyphenyl)-1,3-oxazole-4-carbonitrile
| Molecular Formula | C23H21N5O2 |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 88.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 399.16953 |
| Heavy Atoms | 30 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 848741-90-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC(=C(O3)NCCCN4C=CN=C4)C#N |
| InChIKey | ULUYZWMLARCABI-UHFFFAOYSA-N |
Product Overview
2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile (CAS 848741-90-2), with molecular formula C23H21N5O2 and molecular weight 399.17 g/mol. IUPAC: 5-(3-imidazol-1-ylpropylamino)-2-(4-phenylmethoxyphenyl)-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile
Property Insights of 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile
The XLogP value of 4.5 indicates that 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile. Following Lipinski's Rule of Five, 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile has 1 hydrogen bond donor(s) and 6 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 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile?
The CAS number of 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile is 848741-90-2.
What is the molecular formula of 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile?
The molecular formula of 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile is C23H21N5O2.
What is the molecular weight of 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile?
The molecular weight of 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile is 399.17 g/mol.
Where can I buy 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile?
You can request a quote for 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-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 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(benzyloxy)phenyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.