D314-0206 Screening compound: 1-[2-(4-benzyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-2-methylpiperidine

D314-0206 Screening compound: 1-[2-(4-benzyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-2-methylpiperidine
D314-0206 Screening compound: 1-[2-(4-benzyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-2-methylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound D314-0206
1-[2-(4-benzyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-2-methylpiperidine

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

D314-0206

Molecular Formula

C23H28N4OS (C23 H28 N4 OS)

Compound Name

1-[2-(4-benzyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-2-methylpiperidine

IUPAC name

1-[2-(4-benzyl-35-dimethyl-1H-pyrazol-1-yl)-4-methyl-13-thiazole-5-carbonyl]-2-methylpiperidine

SMILES

CC(CCCC1)N1C(c1c(C)nc(-n2nc(C)c(Cc3ccccc3)c2C)s1)=O

InChI

InChI=1S/C23H28N4OS/c1-15-10-8-9-13-26(15)22(28)21-17(3)24-23(29-21)27-18(4)20(16(2)25-27)14-19-11-6-5-7-12-19/h5-7,11-12,15H,8-10,13-14H2,1-4H3/t15-/m0/s1

InChI Key

WVAHSJFAMDSGCL-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD14818061

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.57

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.613

Distribution Coefficient, logD

4.587

Water Solubility, LogSw

-4.43

Polar Surface Area

40.715

Acid Dissociation Constant (pKa)

21.88

Base Dissociation Constant (pKb)

6.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

D314-0206 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D314-0206 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D314-0206?
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What is the minimum amount of D314-0206 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D314-0206
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D314-0206
  • 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 D314-0206 available by request