6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate
TL;DR: 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate (CAS 62143-74-2) is a chemical compound with molecular formula C20H22N2O5 and molecular weight 370.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-4-oxobutanoate;2-(2-phenyl-1,3-benzoxazol-6-yl)propylazanium
Also Known As: C16H16N2O.1/2C4H6O4, beta-Methyl-2-phenyl-6-benzoxazoleethylamine hemisuccinate, 6-BENZOXAZOLEETHYLAMINE, beta-METHYL-2-PHENYL-, HEMISUCCINATE, C16-H16-N2-O.1/2C4-H6-O4, 4-hydroxy-4-oxobutanoate; 2-(2-phenyl-1,3-benzoxazol-6-yl)propylazanium
| Molecular Formula | C20H22N2O5 |
|---|---|
| Molecular Weight | 370.15 g/mol |
| LogP | 1.44 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.15286 |
| Heavy Atoms | 27 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 62143-74-2 |
|---|---|
| SMILES | CC(C[NH3+])C1=CC2=C(C=C1)N=C(O2)C3=CC=CC=C3.C(CC(=O)[O-])C(=O)O |
| InChIKey | KCKIUQPEYZGQBI-UHFFFAOYSA-N |
Product Overview
6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate (CAS 62143-74-2), with molecular formula C20H22N2O5 and molecular weight 370.15 g/mol. IUPAC: 4-hydroxy-4-oxobutanoate;2-(2-phenyl-1,3-benzoxazol-6-yl)propylazanium.
Chemical Property Profile of 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate
Property Insights of 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate
The XLogP value of 1.44 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate. Following Lipinski's Rule of Five, 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate has 2 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 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate?
The CAS number of 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate is 62143-74-2.
What is the molecular formula of 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate?
The molecular formula of 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate is C20H22N2O5.
What is the molecular weight of 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate?
The molecular weight of 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate is 370.15 g/mol.
Where can I buy 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate?
You can request a quote for 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate?
Yes, KEHONG BIO provides custom synthesis services for 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.