P497-0578 Screening compound: 2-[(benzylcarbamoyl)methyl]-N-cyclopropyl-4-methyl-1,3-thiazole-5-carboxamide

P497-0578 Screening compound: 2-[(benzylcarbamoyl)methyl]-N-cyclopropyl-4-methyl-1,3-thiazole-5-carboxamide
P497-0578 Screening compound: 2-[(benzylcarbamoyl)methyl]-N-cyclopropyl-4-methyl-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P497-0578
2-[(benzylcarbamoyl)methyl]-N-cyclopropyl-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

P497-0578

Molecular Formula

C17H19N3O2S (C17 H19 N3 O2 S)

Compound Name

2-[(benzylcarbamoyl)methyl]-N-cyclopropyl-4-methyl-1,3-thiazole-5-carboxamide

IUPAC name

2-[(benzylcarbamoyl)methyl]-N-cyclopropyl-4-methyl-13-thiazole-5-carboxamide

SMILES

Cc1c(C(NC2CC2)=O)sc(CC(NCc2ccccc2)=O)n1

InChI

InChI=1S/C17H19N3O2S/c1-11-16(17(22)20-13-7-8-13)23-15(19-11)9-14(21)18-10-12-5-3-2-4-6-12/h2-6,13H,7-10H2,1H3,(H,18,21)(H,20,22)

InChI Key

SZCMJXRZCCKQFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27576390

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.080

Distribution Coefficient, logD

2.080

Water Solubility, LogSw

-2.52

Polar Surface Area

59.986

Acid Dissociation Constant (pKa)

12.47

Base Dissociation Constant (pKb)

-0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

P497-0578 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

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 P497-0578 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P497-0578?
Check Price and Availability of P497-0578, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of P497-0578 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P497-0578
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P497-0578
  • 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 P497-0578 available by request