D376-1145 Screening compound: 2-[(3,4-dimethylphenoxy)methyl]-4-methyl-N-[1-(thiophen-2-yl)ethyl]-1,3-thiazole-5-carboxamide

D376-1145 Screening compound: 2-[(3,4-dimethylphenoxy)methyl]-4-methyl-N-[1-(thiophen-2-yl)ethyl]-1,3-thiazole-5-carboxamide
D376-1145 Screening compound: 2-[(3,4-dimethylphenoxy)methyl]-4-methyl-N-[1-(thiophen-2-yl)ethyl]-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D376-1145
2-[(3,4-dimethylphenoxy)methyl]-4-methyl-N-[1-(thiophen-2-yl)ethyl]-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

D376-1145

Molecular Formula

C20H22N2O2S2 (C20 H22 N2 O2 S2)

Compound Name

2-[(3,4-dimethylphenoxy)methyl]-4-methyl-N-[1-(thiophen-2-yl)ethyl]-1,3-thiazole-5-carboxamide

IUPAC name

2-[(34-dimethylphenoxy)methyl]-4-methyl-N-[1-(thiophen-2-yl)ethyl]-13-thiazole-5-carboxamide

SMILES

CC(c1cccs1)NC(c1c(C)nc(COc2cc(C)c(C)cc2)s1)=O

InChI

InChI=1S/C20H22N2O2S2/c1-12-7-8-16(10-13(12)2)24-11-18-21-15(4)19(26-18)20(23)22-14(3)17-6-5-9-25-17/h5-10,14H,11H2,1-4H3,(H,22,23)/t14-/m0/s1

InChI Key

QAOSRHODRXGABU-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27582543

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.54

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.004

Distribution Coefficient, logD

5.004

Water Solubility, LogSw

-4.68

Polar Surface Area

43.138

Acid Dissociation Constant (pKa)

12.35

Base Dissociation Constant (pKb)

-0.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

D376-1145 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 D376-1145 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D376-1145?
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What is the minimum amount of D376-1145 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D376-1145
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D376-1145
  • 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 D376-1145 available by request