3154-0251 Screening compound: N-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]-2-(2-methylphenoxy)acetamide
Chemical Structure Depiction of ChemDiv screening compound 3154-0251
N-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]-2-(2-methylphenoxy)acetamide
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
3154-0251
Molecular Formula
C23H22N4O3 (C23 H22 N4 O3)
Compound Name
N-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]-2-(2-methylphenoxy)acetamide
IUPAC name
N-[2-(4-ethoxyphenyl)-2H-123-benzotriazol-5-yl]-2-(2-methylphenoxy)acetamide
SMILES
CCOc(cc1)ccc1-n1nc(cc(cc2)NC(COc3c(C)cccc3)=O)c2n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
402.45
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
5.173
Distribution Coefficient, logD
5.173
Water Solubility, LogSw
-4.96
Polar Surface Area
61.860
Acid Dissociation Constant (pKa)
10.32
Base Dissociation Constant (pKb)
0.97
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
17.40
3154-0251 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
CORONAVIRUS Library (20774 compounds)
Human Receptors Annotated Library (5376 compounds)
Selective Target Activity Profiling Library (14702 compounds)
Therapeutical Diversity Annotated Library (7563 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cancer
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with 3154-0251 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)