D462-0498 Screening compound: N-[(3,4-dimethylphenyl)(pyridin-3-yl)methyl]pentanamide

D462-0498 Screening compound: N-[(3,4-dimethylphenyl)(pyridin-3-yl)methyl]pentanamide
D462-0498 Screening compound: N-[(3,4-dimethylphenyl)(pyridin-3-yl)methyl]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D462-0498
N-[(3,4-dimethylphenyl)(pyridin-3-yl)methyl]pentanamide

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

D462-0498

Molecular Formula

C19H24N2O (C19 H24 N2 O)

Compound Name

N-[(3,4-dimethylphenyl)(pyridin-3-yl)methyl]pentanamide

IUPAC name

N-[(34-dimethylphenyl)(pyridin-3-yl)methyl]pentanamide

SMILES

CCCCC(NC(c1cc(C)c(C)cc1)c1cnccc1)=O

InChI

InChI=1S/C19H24N2O/c1-4-5-8-18(22)21-19(17-7-6-11-20-13-17)16-10-9-14(2)15(3)12-16/h6-7,9-13,19H,4-5,8H2,1-3H3,(H,21,22)/t19-/m0/s1

InChI Key

GGSLZESFNDLJJT-IBGZPJMESA-N

MDL Number (MFCD)

MFCD14830041

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.939

Distribution Coefficient, logD

3.937

Water Solubility, LogSw

-3.53

Polar Surface Area

33.308

Acid Dissociation Constant (pKa)

11.67

Base Dissociation Constant (pKb)

5.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

D462-0498 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D462-0498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D462-0498?
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What is the minimum amount of D462-0498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D462-0498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D462-0498
  • 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 D462-0498 available by request