4031-1250 Screening compound: N'-benzyl-N-(4-bromophenyl)ethanediamide
Chemical Structure Depiction of ChemDiv screening compound 4031-1250
N'-benzyl-N-(4-bromophenyl)ethanediamide
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
4031-1250
Molecular Formula
C15H13BrN2O2 (C15 H13 BrN2 O2)
Compound Name
N'-benzyl-N-(4-bromophenyl)ethanediamide
IUPAC name
N'-benzyl-N-(4-bromophenyl)ethanediamide
SMILES
O=C(C(Nc(cc1)ccc1Br)=O)NCc1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
333.18
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
3.019
Distribution Coefficient, logD
2.161
Water Solubility, LogSw
-3.36
Polar Surface Area
48.014
Acid Dissociation Constant (pKa)
6.61
Base Dissociation Constant (pKb)
1.77
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
6.70
4031-1250 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
Anti-Aging Library (44940 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Included in 1.7M Stock Database
- 3D
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Epigenetic
- Proteases
References: we are preparing a list of scientific research reports with 4031-1250 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)