D314-0429 Screening compound: N-[4-(dimethylamino)phenyl]-2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide

D314-0429 Screening compound: N-[4-(dimethylamino)phenyl]-2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide
D314-0429 Screening compound: N-[4-(dimethylamino)phenyl]-2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D314-0429
N-[4-(dimethylamino)phenyl]-2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide

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

D314-0429

Molecular Formula

C26H29N5O2S (C26 H29 N5 O2 S)

Compound Name

N-[4-(dimethylamino)phenyl]-2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide

IUPAC name

N-[4-(dimethylamino)phenyl]-2-{4-[(4-methoxyphenyl)methyl]-35-dimethyl-1H-pyrazol-1-yl}-4-methyl-13-thiazole-5-carboxamide

SMILES

Cc1c(Cc(cc2)ccc2OC)c(C)nn1-c1nc(C)c(C(Nc(cc2)ccc2N(C)C)=O)s1

InChI

InChI=1S/C26H29N5O2S/c1-16-23(15-19-7-13-22(33-6)14-8-19)18(3)31(29-16)26-27-17(2)24(34-26)25(32)28-20-9-11-21(12-10-20)30(4)5/h7-14H,15H2,1-6H3,(H,28,32)

InChI Key

HWDROYPXWHPWAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14818174

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.045

Distribution Coefficient, logD

5.037

Water Solubility, LogSw

-4.67

Polar Surface Area

58.222

Acid Dissociation Constant (pKa)

10.57

Base Dissociation Constant (pKb)

9.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

D314-0429 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D314-0429 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D314-0429?
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What is the minimum amount of D314-0429 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D314-0429
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D314-0429
  • 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 D314-0429 available by request