Y031-7572 Screening compound: N-(3-chloro-4-fluorophenyl)-N,N-dimethyltetrahydro-1,4(2H)-pyridinedicarboxamide

Y031-7572 Screening compound: N-(3-chloro-4-fluorophenyl)-N,N-dimethyltetrahydro-1,4(2H)-pyridinedicarboxamide
Y031-7572 Screening compound: N-(3-chloro-4-fluorophenyl)-N,N-dimethyltetrahydro-1,4(2H)-pyridinedicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-7572
N-(3-chloro-4-fluorophenyl)-N,N-dimethyltetrahydro-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

Y031-7572

Molecular Formula

C15H19ClFN3O2 (C15 H19 ClFN3 O2)

Compound Name

N-(3-chloro-4-fluorophenyl)-N,N-dimethyltetrahydro-1,4(2H)-pyridinedicarboxamide

IUPAC name

N4-(3-chloro-4-fluorophenyl)-N1N1-dimethylpiperidine-14-dicarboxamide

SMILES

CN(C)C(N(CC1)CCC1C(Nc(cc1)cc(Cl)c1F)=O)=O

InChI

InChI=1S/C15H19ClFN3O2/c1-19(2)15(22)20-7-5-10(6-8-20)14(21)18-11-3-4-13(17)12(16)9-11/h3-4,9-10H,5-8H2,1-2H3,(H,18,21)

InChI Key

NWNYYSURJHWTLR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15180570

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.79

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.247

Distribution Coefficient, logD

2.206

Water Solubility, LogSw

-3.34

Polar Surface Area

41.136

Acid Dissociation Constant (pKa)

8.40

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.67

Y031-7572 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y031-7572 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-7572?
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What is the minimum amount of Y031-7572 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-7572
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-7572
  • 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 Y031-7572 available by request