P861-0385 Screening compound: 5-[(2-methoxyethyl)amino]-3-methyl-6-(3-methylphenyl)-N-[(pyridin-2-yl)methyl]imidazo[2,1-b][1,3]thiazole-2-carboxamide

P861-0385 Screening compound: 5-[(2-methoxyethyl)amino]-3-methyl-6-(3-methylphenyl)-N-[(pyridin-2-yl)methyl]imidazo[2,1-b][1,3]thiazole-2-carboxamide
P861-0385 Screening compound: 5-[(2-methoxyethyl)amino]-3-methyl-6-(3-methylphenyl)-N-[(pyridin-2-yl)methyl]imidazo[2,1-b][1,3]thiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P861-0385
5-[(2-methoxyethyl)amino]-3-methyl-6-(3-methylphenyl)-N-[(pyridin-2-yl)methyl]imidazo[2,1-b][1,3]thiazole-2-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

P861-0385

Molecular Formula

C23H25N5O2S (C23 H25 N5 O2 S)

Compound Name

5-[(2-methoxyethyl)amino]-3-methyl-6-(3-methylphenyl)-N-[(pyridin-2-yl)methyl]imidazo[2,1-b][1,3]thiazole-2-carboxamide

IUPAC name

5-[(2-methoxyethyl)amino]-3-methyl-6-(3-methylphenyl)-N-[(pyridin-2-yl)methyl]imidazo[21-b][13]thiazole-2-carboxamide

SMILES

Cc1c(C(NCc2ncccc2)=O)sc2nc(-c3cc(C)ccc3)c(NCCOC)n12

InChI

InChI=1S/C23H25N5O2S/c1-15-7-6-8-17(13-15)19-21(25-11-12-30-3)28-16(2)20(31-23(28)27-19)22(29)26-14-18-9-4-5-10-24-18/h4-10,13,25H,11-12,14H2,1-3H3,(H,26,29)

InChI Key

FSOKTRKKBIDZCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27615657

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.743

Distribution Coefficient, logD

3.743

Water Solubility, LogSw

-3.94

Polar Surface Area

62.058

Acid Dissociation Constant (pKa)

11.81

Base Dissociation Constant (pKb)

4.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

P861-0385 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
Targets:
  • Proteases
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with P861-0385 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P861-0385?
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What is the minimum amount of P861-0385 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P861-0385
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P861-0385
  • 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 P861-0385 available by request