M667-0851 Screening compound: N3-benzyl-N1-{4-[(propylcarbamoyl)amino]phenyl}piperidine-1,3-dicarboxamide

M667-0851 Screening compound: N3-benzyl-N1-{4-[(propylcarbamoyl)amino]phenyl}piperidine-1,3-dicarboxamide
M667-0851 Screening compound: N3-benzyl-N1-{4-[(propylcarbamoyl)amino]phenyl}piperidine-1,3-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M667-0851
N3-benzyl-N1-{4-[(propylcarbamoyl)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

M667-0851

Molecular Formula

C24H31N5O3 (C24 H31 N5 O3)

Compound Name

N3-benzyl-N1-{4-[(propylcarbamoyl)amino]phenyl}piperidine-1,3-dicarboxamide

IUPAC name

N3-benzyl-N1-{4-[(propylcarbamoyl)amino]phenyl}piperidine-13-dicarboxamide

SMILES

CCCNC(Nc(cc1)ccc1NC(N(CCC1)CC1C(NCc1ccccc1)=O)=O)=O

InChI

InChI=1S/C24H31N5O3/c1-2-14-25-23(31)27-20-10-12-21(13-11-20)28-24(32)29-15-6-9-19(17-29)22(30)26-16-18-7-4-3-5-8-18/h3-5,7-8,10-13,19H,2,6,9,14-17H2,1H3,(H,26,30)(H,28,32)(H2,25,27,31)/t19-/m0/s1

InChI Key

LJERRPBHYUJKAM-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27550254

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.760

Distribution Coefficient, logD

2.760

Water Solubility, LogSw

-3.16

Polar Surface Area

83.792

Acid Dissociation Constant (pKa)

12.49

Base Dissociation Constant (pKb)

2.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

M667-0851 in Drug Discovery

Included in Screening Libraries

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

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with M667-0851 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M667-0851?
Check Price and Availability of M667-0851, 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 M667-0851 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M667-0851
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M667-0851
  • 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 M667-0851 available by request