C875-0058 Screening compound: 2-{3H-imidazo[4,5-c]pyridin-2-ylsulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of ChemDiv screening compound C875-0058
2-{3H-imidazo[4,5-c]pyridin-2-ylsulfanyl}-N-[3-(methylsulfanyl)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
C875-0058
Molecular Formula
C15H14N4OS2 (C15 H14 N4 OS2)
Compound Name
2-{3H-imidazo[4,5-c]pyridin-2-ylsulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide
IUPAC name
2-{3H-imidazo[45-c]pyridin-2-ylsulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide
SMILES
CSc1cccc(NC(CSc2nc(ccnc3)c3[nH]2)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
330.43
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.368
Distribution Coefficient, logD
2.309
Water Solubility, LogSw
-2.55
Polar Surface Area
50.647
Acid Dissociation Constant (pKa)
12.20
Base Dissociation Constant (pKb)
6.48
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
13.30
C875-0058 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
Anti-Inflammatory Library (24602 compounds)
Chelators targeting matrix metalloproteinases library (8930 compounds)
NOTUM (Wnt signaling) Library (3881 compounds)
Nucleic Acid Ligands (8311 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Immune system
- Cancer
- Digestive system
- Cardiovascular
- Infections
- Cancer
- Musculoskeletal
- Nervous system
- Hemic and lymphatic
- Immune system
- Epigenetic
- Proteases
References: we are preparing a list of scientific research reports with C875-0058 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)