RefChem:351884
TL;DR: RefChem:351884 (CAS 101756-39-2) is a chemical compound with molecular formula C17H18N4O and molecular weight 294.14807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[4,5-dihydro-1,3-oxazol-2-yl(5,6,7,8-tetrahydronaphthalen-1-yl)amino]methyl]propanedinitrile
Also Known As: Malononitrile, (N-(2-oxazolin-2-yl)-N-(5,6,7,8-tetrahydro-1-naphthyl)aminomethyl)-, N-(2-Oxazolin-2-yl)-N-(5,6,7,8-tetrahydro-1-naphthyl)aminomethylmalononitrile, 2-Oxazolin-2-yl 5,6,7,8-tetrahydronaphthalen-1-ylaminomethylmalononitrile, {[(4,5-Dihydro-1,3-oxazol-2-yl)(5,6,7,8-tetrahydronaphthalen-1-yl)amino]methyl}propanedinitrile, {[4,5-dihydro-1,3-oxazol-2-yl(5,6,7,8-tetrahydronaphthalen-1-yl)amino]methyl}propanedinitrile
Technical Specifications
| Molecular Formula | C17H18N4O |
| Molecular Weight | 294.14807 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 72.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.14807 Da |
| Heavy Atoms | 22 |
| Complexity | 509.0 |
| SMILES | C1CCC2=C(C1)C=CC=C2N(CC(C#N)C#N)C3=NCCO3 |
| InChIKey | YSCCRNNFOIYVEK-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:351884
Property Insights of RefChem:351884
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:351884. The TPSA of 72.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:351884. Following Lipinski's Rule of Five, RefChem:351884 has 0 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 RefChem:351884?
The CAS number of RefChem:351884 is 101756-39-2.
What is the molecular formula of RefChem:351884?
The molecular formula of RefChem:351884 is C17H18N4O.
What is the molecular weight of RefChem:351884?
The molecular weight of RefChem:351884 is 294.14807 g/mol.
Where can I buy RefChem:351884?
You can request a quote for RefChem:351884 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:351884?
Yes, CoreyChem provides custom synthesis services for RefChem:351884 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.