M665-1081 Screening compound: N-(4-{[(3,5-dimethylanilino)carbonyl]amino}phenyl)-N-methyltetrahydro-1,4(2H)-pyridinedicarboxamide

M665-1081 Screening compound: N-(4-{[(3,5-dimethylanilino)carbonyl]amino}phenyl)-N-methyltetrahydro-1,4(2H)-pyridinedicarboxamide
M665-1081 Screening compound: N-(4-{[(3,5-dimethylanilino)carbonyl]amino}phenyl)-N-methyltetrahydro-1,4(2H)-pyridinedicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M665-1081
N-(4-{[(3,5-dimethylanilino)carbonyl]amino}phenyl)-N-methyltetrahydro-1,4(2H)-pyridinedicarboxamide

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

M665-1081

Molecular Formula

C23H29N5O3 (C23 H29 N5 O3)

Compound Name

N-(4-{[(3,5-dimethylanilino)carbonyl]amino}phenyl)-N-methyltetrahydro-1,4(2H)-pyridinedicarboxamide

IUPAC name

N1-(4-{[(35-dimethylphenyl)carbamoyl]amino}phenyl)-N4-methylpiperidine-14-dicarboxamide

SMILES

Cc1cc(NC(Nc(cc2)ccc2NC(N(CC2)CCC2C(NC)=O)=O)=O)cc(C)c1

InChI

InChI=1S/C23H29N5O3/c1-15-12-16(2)14-20(13-15)26-22(30)25-18-4-6-19(7-5-18)27-23(31)28-10-8-17(9-11-28)21(29)24-3/h4-7,12-14,17H,8-11H2,1-3H3,(H,24,29)(H,27,31)(H2,25,26,30)

InChI Key

SUIJMKHPZOMEMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27550232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.192

Distribution Coefficient, logD

3.192

Water Solubility, LogSw

-3.25

Polar Surface Area

82.846

Acid Dissociation Constant (pKa)

13.91

Base Dissociation Constant (pKb)

-0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.78

M665-1081 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with M665-1081 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M665-1081?
Check Price and Availability of M665-1081, 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 M665-1081 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M665-1081
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M665-1081
  • 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 M665-1081 available by request