M477-0097 Screening compound: 3-fluoro-4-methoxy-N-(2-{3-methyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)benzamide

M477-0097 Screening compound: 3-fluoro-4-methoxy-N-(2-{3-methyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)benzamide
M477-0097 Screening compound: 3-fluoro-4-methoxy-N-(2-{3-methyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M477-0097
3-fluoro-4-methoxy-N-(2-{3-methyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)benzamide

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

M477-0097

Molecular Formula

C17H17FN4O2 (C17 H17 FN4 O2)

Compound Name

3-fluoro-4-methoxy-N-(2-{3-methyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)benzamide

IUPAC name

3-fluoro-4-methoxy-N-(2-{3-methyl-3H-imidazo[45-b]pyridin-2-yl}ethyl)benzamide

SMILES

Cn1c(nccc2)c2nc1CCNC(c(cc1)cc(F)c1OC)=O

InChI

InChI=1S/C17H17FN4O2/c1-22-15(21-13-4-3-8-19-16(13)22)7-9-20-17(23)11-5-6-14(24-2)12(18)10-11/h3-6,8,10H,7,9H2,1-2H3,(H,20,23)

InChI Key

SIZQWRGJJLZOOH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27544207

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.539

Distribution Coefficient, logD

1.539

Water Solubility, LogSw

-2.01

Polar Surface Area

54.017

Acid Dissociation Constant (pKa)

12.68

Base Dissociation Constant (pKb)

3.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

M477-0097 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M477-0097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M477-0097?
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What is the minimum amount of M477-0097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M477-0097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M477-0097
  • 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 M477-0097 available by request