2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one
TL;DR: 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one (CAS 147861-19-6) is a chemical compound with molecular formula C20H15N3O and molecular weight 313.12152 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(benzotriazol-1-yl)-1,2-diphenylethanone
Also Known As: CBKinase1_001897, CBKinase1_014297, 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one, 2-(benzotriazol-1-yl)-1,2-diphenylethanone, 2-(benzotriazol-1-yl)-1,2-diphenyl-ethanone
Technical Specifications
| Molecular Formula | C20H15N3O |
| Molecular Weight | 313.12152 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 47.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.12152 Da |
| Heavy Atoms | 24 |
| Complexity | 429.0 |
| SMILES | C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)N3C4=CC=CC=C4N=N3 |
| InChIKey | DVVYSUCBMDZKKF-UHFFFAOYSA-N |
Chemical Property Profile of 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one
Property Insights of 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one
The XLogP value of 4.3 indicates that 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.8 Ų, 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one?
The CAS number of 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one is 147861-19-6.
What is the molecular formula of 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one?
The molecular formula of 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one is C20H15N3O.
What is the molecular weight of 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one?
The molecular weight of 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one is 313.12152 g/mol.
Where can I buy 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one?
You can request a quote for 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one?
Yes, CoreyChem provides custom synthesis services for 2-(1H-1,2,3-Benzotriazol-1-yl)-1,2-diphenylethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.