N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine
TL;DR: N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine (CAS 163808-10-4) is a chemical compound with molecular formula C14H11N5O and molecular weight 265.09637 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(benzotriazol-1-ylmethyl)-1,3-benzoxazol-4-amine
Also Known As: N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine, N-(benzotriazol-1-ylmethyl)benzooxazol-4-amine, N-(benzotriazol-1-ylmethyl)-1,3-benzoxazol-4-amine, N-[(1H-Benzotriazol-1-yl)methyl]-1,3-benzoxazol-4-amine
Technical Specifications
| Molecular Formula | C14H11N5O |
| Molecular Weight | 265.09637 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 68.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.09637 Da |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
| SMILES | C1=CC=C2C(=C1)N=NN2CNC3=C4C(=CC=C3)OC=N4 |
| InChIKey | VKFWZIAKWXPXJB-UHFFFAOYSA-N |
Chemical Property Profile of N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine
Property Insights of N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine. Following Lipinski's Rule of Five, N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine?
The CAS number of N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine is 163808-10-4.
What is the molecular formula of N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine?
The molecular formula of N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine is C14H11N5O.
What is the molecular weight of N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine?
The molecular weight of N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine is 265.09637 g/mol.
Where can I buy N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine?
You can request a quote for N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine?
Yes, CoreyChem provides custom synthesis services for N-4-Benzoxazolyl-1H-benzotriazole-1-methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.