M512-0002 Screening compound: 5-(4-bromobenzoyl)-1H,4H,5H,6H,7H-imidazo[4,5-c]pyridine
Chemical Structure Depiction of ChemDiv screening compound M512-0002
5-(4-bromobenzoyl)-1H,4H,5H,6H,7H-imidazo[4,5-c]pyridine
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
M512-0002
Molecular Formula
C13H12BrN3O (C13 H12 BrN3 O)
Compound Name
5-(4-bromobenzoyl)-1H,4H,5H,6H,7H-imidazo[4,5-c]pyridine
IUPAC name
5-(4-bromobenzoyl)-1H4H5H6H7H-imidazo[45-c]pyridine
SMILES
O=C(c(cc1)ccc1Br)N(CC1)Cc2c1[nH]cn2
InChI
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
306.16
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
1.573
Distribution Coefficient, logD
1.542
Water Solubility, LogSw
-2.16
Polar Surface Area
40.379
Acid Dissociation Constant (pKa)
14.41
Base Dissociation Constant (pKb)
6.28
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
23.10
M512-0002 in Drug Discovery
Included in Screening Libraries
3CLpro Library (4801 compounds)
Antiviral Library (67538 compounds)
CNS BBB Library (22607 compounds)
CORONAVIRUS Library (20774 compounds)
Cardiovascular Library (22201 compounds)
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Soluble Diversity Library (15920 compounds)
Anti-HIV1 Library (19540 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Crystallographic and 19F NMR fragment-libraries (624 compounds)
Ion Channels Focused Library (26372 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- Nervous system
- Nervous system
- Antiviral
- Infections
- Immune system
- Cardiovascular
- Antiviral
- Infections
- Immune system
- Nervous system
- Cardiovascular
- PPI modulators
- Cyclic compounds
- Ion Channels
References: we are preparing a list of scientific research reports with M512-0002 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)