4207-4495 Screening compound: 2-(N-benzyl4-bromobenzenesulfonamido)-N-[2-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of ChemDiv screening compound 4207-4495
2-(N-benzyl4-bromobenzenesulfonamido)-N-[2-(trifluoromethyl)phenyl]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
4207-4495
Molecular Formula
C22H18BrF3N2O3S (C22 H18 BrF3 N2 O3 S)
Compound Name
2-(N-benzyl4-bromobenzenesulfonamido)-N-[2-(trifluoromethyl)phenyl]acetamide
IUPAC name
2-(N-benzyl4-bromobenzenesulfonamido)-N-[2-(trifluoromethyl)phenyl]acetamide
SMILES
O=C(CN(Cc1ccccc1)S(c(cc1)ccc1Br)(=O)=O)Nc1c(C(F)(F)F)cccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
527.36
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
5.538
Distribution Coefficient, logD
5.538
Water Solubility, LogSw
-5.74
Polar Surface Area
53.794
Acid Dissociation Constant (pKa)
10.64
Base Dissociation Constant (pKb)
-1.88
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
13.60
4207-4495 in Drug Discovery
Included in Screening Libraries
Antiviral HBV Library (10007 compounds)
Cardiovascular Library (22201 compounds)
Antibacterial Compounds Library (13827 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cardiovascular
- Infections
- Immune system
- animal
References: we are preparing a list of scientific research reports with 4207-4495 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)