M742-0160 Screening compound: N,N-dimethyl-4-(3-{[4-(pyrrolidine-1-carbonyl)phenoxy]methyl}piperidine-1-carbonyl)aniline

M742-0160 Screening compound: N,N-dimethyl-4-(3-{[4-(pyrrolidine-1-carbonyl)phenoxy]methyl}piperidine-1-carbonyl)aniline
M742-0160 Screening compound: N,N-dimethyl-4-(3-{[4-(pyrrolidine-1-carbonyl)phenoxy]methyl}piperidine-1-carbonyl)aniline alternative view

Chemical Structure Depiction of ChemDiv screening compound M742-0160
N,N-dimethyl-4-(3-{[4-(pyrrolidine-1-carbonyl)phenoxy]methyl}piperidine-1-carbonyl)aniline

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

M742-0160

Molecular Formula

C26H33N3O3 (C26 H33 N3 O3)

Compound Name

N,N-dimethyl-4-(3-{[4-(pyrrolidine-1-carbonyl)phenoxy]methyl}piperidine-1-carbonyl)aniline

IUPAC name

NN-dimethyl-4-(3-{[4-(pyrrolidine-1-carbonyl)phenoxy]methyl}piperidine-1-carbonyl)aniline

SMILES

CN(C)c(cc1)ccc1C(N1CC(COc(cc2)ccc2C(N2CCCC2)=O)CCC1)=O

InChI

InChI=1S/C26H33N3O3/c1-27(2)23-11-7-21(8-12-23)26(31)29-17-5-6-20(18-29)19-32-24-13-9-22(10-14-24)25(30)28-15-3-4-16-28/h7-14,20H,3-6,15-19H2,1-2H3/t20-/m0/s1

InChI Key

QRHBOEKCFZZETB-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27552514

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.57

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

3.418

Distribution Coefficient, logD

3.418

Water Solubility, LogSw

-3.63

Polar Surface Area

43.867

Acid Dissociation Constant (pKa)

25.04

Base Dissociation Constant (pKb)

8.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.20

M742-0160 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M742-0160 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M742-0160?
Check Price and Availability of M742-0160, 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 M742-0160 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M742-0160
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M742-0160
  • 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 M742-0160 available by request