C875-0270 Screening compound: 1-(azepan-1-yl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)ethan-1-one

C875-0270 Screening compound: 1-(azepan-1-yl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)ethan-1-one
C875-0270 Screening compound: 1-(azepan-1-yl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C875-0270
1-(azepan-1-yl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)ethan-1-one

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

C875-0270

Molecular Formula

C21H23FN4OS (C21 H23 FN4 OS)

Compound Name

1-(azepan-1-yl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)ethan-1-one

IUPAC name

1-(azepan-1-yl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[45-c]pyridin-3-yl)ethan-1-one

SMILES

O=C(Cn1c(SCc2cc(F)ccc2)nc2c1cncc2)N1CCCCCC1

InChI

InChI=1S/C21H23FN4OS/c22-17-7-5-6-16(12-17)15-28-21-24-18-8-9-23-13-19(18)26(21)14-20(27)25-10-3-1-2-4-11-25/h5-9,12-13H,1-4,10-11,14-15H2

InChI Key

HSQUHRGWLRADHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14802297

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.996

Distribution Coefficient, logD

3.953

Water Solubility, LogSw

-3.94

Polar Surface Area

36.719

Acid Dissociation Constant (pKa)

18.77

Base Dissociation Constant (pKb)

6.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

C875-0270 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with C875-0270 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C875-0270?
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What is the minimum amount of C875-0270 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C875-0270
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C875-0270
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of C875-0270 available by request