M105-1072 Screening compound: [1-(1-BENZYL-1H-PYRROLO[3,2-C]PYRIDIN-4-YL)-4-PIPERIDYL][4-(4-FLUOROPHENYL)PIPERAZINO]METHANONE

M105-1072 Screening compound: [1-(1-BENZYL-1H-PYRROLO[3,2-C]PYRIDIN-4-YL)-4-PIPERIDYL][4-(4-FLUOROPHENYL)PIPERAZINO]METHANONE
M105-1072 Screening compound: [1-(1-BENZYL-1H-PYRROLO[3,2-C]PYRIDIN-4-YL)-4-PIPERIDYL][4-(4-FLUOROPHENYL)PIPERAZINO]METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound M105-1072
[1-(1-BENZYL-1H-PYRROLO[3,2-C]PYRIDIN-4-YL)-4-PIPERIDYL][4-(4-FLUOROPHENYL)PIPERAZINO]METHANONE

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

M105-1072

Molecular Formula

C30H32FN5O (C30 H32 FN5 O)

Compound Name

[1-(1-BENZYL-1H-PYRROLO[3,2-C]PYRIDIN-4-YL)-4-PIPERIDYL][4-(4-FLUOROPHENYL)PIPERAZINO]METHANONE

IUPAC name

n/a

SMILES

O=C(C(CC1)CCN1c1nccc2c1ccn2Cc1ccccc1)N(CC1)CCN1c(cc1)ccc1F

InChI

InChI=1S/C30H32FN5O/c31-25-6-8-26(9-7-25)33-18-20-35(21-19-33)30(37)24-11-15-34(16-12-24)29-27-13-17-36(28(27)10-14-32-29)22-23-4-2-1-3-5-23/h1-10,13-14,17,24H,11-12,15-16,18-22H2

InChI Key

OVYYTKYKMSGMBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27496963

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.62

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.913

Distribution Coefficient, logD

3.448

Water Solubility, LogSw

-4.97

Polar Surface Area

34.419

Acid Dissociation Constant (pKa)

21.78

Base Dissociation Constant (pKb)

8.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

M105-1072 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with M105-1072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M105-1072?
Check Price and Availability of M105-1072, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M105-1072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M105-1072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M105-1072
  • 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 M105-1072 available by request