1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone
TL;DR: 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone (CAS 166740-16-5) is a chemical compound with molecular formula C20H16N4O and molecular weight 328.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzotriazol-1-yl)-2-(N-phenylanilino)ethanone
Also Known As: 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone, NCI60_018812, 1-(benzotriazol-1-yl)-2-(N-phenylanilino)ethanone, 1-(1H-Benzotriazol-1-yl)-2-(diphenylamino)ethan-1-one, 1-(1H-1,2,3-benzotriazol-1-yl)-2-(diphenylamino)ethan-1-one
| Molecular Formula | C20H16N4O |
|---|---|
| Molecular Weight | 328.13 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 51.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.13242 |
| Heavy Atoms | 25 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 166740-16-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(CC(=O)N2C3=CC=CC=C3N=N2)C4=CC=CC=C4 |
| InChIKey | ZDNPIBGXEWTIJR-UHFFFAOYSA-N |
Product Overview
1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone (CAS 166740-16-5), with molecular formula C20H16N4O and molecular weight 328.13 g/mol. IUPAC: 1-(benzotriazol-1-yl)-2-(N-phenylanilino)ethanone.
Chemical Property Profile of 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone
Property Insights of 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone
The XLogP value of 4.4 indicates that 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.0 Ų, 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone 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
Frequently Asked Questions
What is the CAS number of 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone?
The CAS number of 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone is 166740-16-5.
What is the molecular formula of 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone?
The molecular formula of 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone is C20H16N4O.
What is the molecular weight of 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone?
The molecular weight of 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone is 328.13 g/mol.
Where can I buy 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone?
You can request a quote for 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-benzotriazol-1-yl)-2-(diphenylamino)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.