N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine
TL;DR: N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine (CAS 100134-50-7) is a chemical compound with molecular formula C12H14N2O and molecular weight 202.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine
Also Known As: benzyl-(3,4-dimethyl-isoxazol-5-yl)-amine, N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine
| Molecular Formula | C12H14N2O |
|---|---|
| Molecular Weight | 202.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.11061 |
| Heavy Atoms | 15 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 100134-50-7 |
|---|---|
| SMILES | CC1=C(ON=C1C)NCC2=CC=CC=C2 |
| InChIKey | FHNFGBLQNQAWFK-UHFFFAOYSA-N |
Product Overview
N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine (CAS 100134-50-7), with molecular formula C12H14N2O and molecular weight 202.11 g/mol. IUPAC: N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine.
Chemical Property Profile of N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine
Property Insights of N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine. With a topological polar surface area (TPSA) of 38.1 Ų, N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine has 1 hydrogen bond donor(s) and 3 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 N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine?
The CAS number of N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine is 100134-50-7.
What is the molecular formula of N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine?
The molecular formula of N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine is C12H14N2O.
What is the molecular weight of N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine?
The molecular weight of N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine is 202.11 g/mol.
Where can I buy N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine?
You can request a quote for N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-3,4-dimethyl-1,2-oxazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.