M667-1052 Screening compound: N3-cyclohexyl-N1-(4-{[(2-methylpropyl)carbamoyl]amino}phenyl)piperidine-1,3-dicarboxamide

M667-1052 Screening compound: N3-cyclohexyl-N1-(4-{[(2-methylpropyl)carbamoyl]amino}phenyl)piperidine-1,3-dicarboxamide
M667-1052 Screening compound: N3-cyclohexyl-N1-(4-{[(2-methylpropyl)carbamoyl]amino}phenyl)piperidine-1,3-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M667-1052
N3-cyclohexyl-N1-(4-{[(2-methylpropyl)carbamoyl]amino}phenyl)piperidine-1,3-dicarboxamide

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

M667-1052

Molecular Formula

C24H37N5O3 (C24 H37 N5 O3)

Compound Name

N3-cyclohexyl-N1-(4-{[(2-methylpropyl)carbamoyl]amino}phenyl)piperidine-1,3-dicarboxamide

IUPAC name

N3-cyclohexyl-N1-(4-{[(2-methylpropyl)carbamoyl]amino}phenyl)piperidine-13-dicarboxamide

SMILES

CC(C)CNC(Nc(cc1)ccc1NC(N(CCC1)CC1C(NC1CCCCC1)=O)=O)=O

InChI

InChI=1S/C24H37N5O3/c1-17(2)15-25-23(31)27-20-10-12-21(13-11-20)28-24(32)29-14-6-7-18(16-29)22(30)26-19-8-4-3-5-9-19/h10-13,17-19H,3-9,14-16H2,1-2H3,(H,26,30)(H,28,32)(H2,25,27,31)/t18-/m0/s1

InChI Key

KINJCKWLPJMKEQ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27550299

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.59

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.621

Distribution Coefficient, logD

3.621

Water Solubility, LogSw

-3.72

Polar Surface Area

83.676

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

2.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

62.50

M667-1052 in Drug Discovery

Included in Screening Libraries

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

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with M667-1052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M667-1052?
Check Price and Availability of M667-1052, 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 M667-1052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M667-1052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M667-1052
  • 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 M667-1052 available by request