C875-0675 Screening compound: N-cyclohexyl-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)-N-methylacetamide
Chemical Structure Depiction of ChemDiv screening compound C875-0675
N-cyclohexyl-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)-N-methylacetamide
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
C875-0675
Molecular Formula
C22H25FN4OS (C22 H25 FN4 OS)
Compound Name
N-cyclohexyl-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)-N-methylacetamide
IUPAC name
N-cyclohexyl-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[45-c]pyridin-3-yl)-N-methylacetamide
SMILES
CN(C1CCCCC1)C(Cn1c(SCc(cccc2)c2F)nc2c1cncc2)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
412.53
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.467
Distribution Coefficient, logD
4.453
Water Solubility, LogSw
-4.13
Polar Surface Area
34.942
Acid Dissociation Constant (pKa)
18.77
Base Dissociation Constant (pKb)
5.90
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
40.90
C875-0675 in Drug Discovery
Included in Screening Libraries
CNS BBB Library (22607 compounds)
Nucleic Acid Ligands (8311 compounds)
Included in 1.7M Stock Database
- Nervous system
- Infections
- Cancer
- Musculoskeletal
- Nervous system
- Hemic and lymphatic
- Immune system
References: we are preparing a list of scientific research reports with C875-0675 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)