R153-0137 Screening compound: 1-(4-bromophenyl)-2-methyl-1H-1,3-benzodiazole-5-carboxylic acid
Chemical Structure Depiction of ChemDiv screening compound R153-0137
1-(4-bromophenyl)-2-methyl-1H-1,3-benzodiazole-5-carboxylic acid
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
R153-0137
Molecular Formula
C15H11BrN2O2 (C15 H11 BrN2 O2)
Compound Name
1-(4-bromophenyl)-2-methyl-1H-1,3-benzodiazole-5-carboxylic acid
IUPAC name
1-(4-bromophenyl)-2-methyl-1H-13-benzodiazole-5-carboxylic acid
SMILES
Cc1nc(cc(cc2)C(O)=O)c2n1-c(cc1)ccc1Br
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
331.17
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
3.959
Distribution Coefficient, logD
1.761
Water Solubility, LogSw
-4.03
Polar Surface Area
40.096
Acid Dissociation Constant (pKa)
5.48
Base Dissociation Constant (pKb)
5.26
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
6.70
R153-0137 in Drug Discovery
Included in Screening Libraries
Anti-Inflammatory Library (24602 compounds)
Antiviral Library (67538 compounds)
Cardiovascular Library (22201 compounds)
Lipid Metabolism Library (9174 compounds)
RNA-Protein Interaction Inhibitors Library (1986 compounds)
Epigenetics Focused Set (26518 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Immune system
- Antiviral
- Infections
- Immune system
- Cardiovascular
- Cardiovascular
- Metabolic
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Epigenetic
- Agro
References: we are preparing a list of scientific research reports with R153-0137 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)