M056-0750 Screening compound: 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-(4-{[(4-methoxyphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)ethan-1-one

M056-0750 Screening compound: 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-(4-{[(4-methoxyphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)ethan-1-one
M056-0750 Screening compound: 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-(4-{[(4-methoxyphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M056-0750
1-[4-(2-fluorophenyl)piperazin-1-yl]-2-(4-{[(4-methoxyphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-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

M056-0750

Molecular Formula

C27H27FN4O2S (C27 H27 FN4 O2 S)

Compound Name

1-[4-(2-fluorophenyl)piperazin-1-yl]-2-(4-{[(4-methoxyphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)ethan-1-one

IUPAC name

1-[4-(2-fluorophenyl)piperazin-1-yl]-2-(4-{[(4-methoxyphenyl)methyl]sulfanyl}-1H-pyrrolo[32-c]pyridin-1-yl)ethan-1-one

SMILES

COc1ccc(CSc2nccc3c2ccn3CC(N(CC2)CCN2c(cccc2)c2F)=O)cc1

InChI

InChI=1S/C27H27FN4O2S/c1-34-21-8-6-20(7-9-21)19-35-27-22-11-13-32(24(22)10-12-29-27)18-26(33)31-16-14-30(15-17-31)25-5-3-2-4-23(25)28/h2-13H,14-19H2,1H3

InChI Key

NQSULDUTKKDWKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27643427

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.007

Distribution Coefficient, logD

3.995

Water Solubility, LogSw

-4.12

Polar Surface Area

37.881

Acid Dissociation Constant (pKa)

21.64

Base Dissociation Constant (pKb)

5.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with M056-0750 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M056-0750?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M056-0750
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M056-0750
  • 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 M056-0750 available by request