P053-3027 Screening compound: N4-cycloheptyl-N2-cyclopentyl-1,3-thiazole-2,4-dicarboxamide

P053-3027 Screening compound: N4-cycloheptyl-N2-cyclopentyl-1,3-thiazole-2,4-dicarboxamide
P053-3027 Screening compound: N4-cycloheptyl-N2-cyclopentyl-1,3-thiazole-2,4-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P053-3027
N4-cycloheptyl-N2-cyclopentyl-1,3-thiazole-2,4-dicarboxamide

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

P053-3027

Molecular Formula

C17H25N3O2S (C17 H25 N3 O2 S)

Compound Name

N4-cycloheptyl-N2-cyclopentyl-1,3-thiazole-2,4-dicarboxamide

IUPAC name

N4-cycloheptyl-N2-cyclopentyl-13-thiazole-24-dicarboxamide

SMILES

O=C(c1csc(C(NC2CCCC2)=O)n1)NC1CCCCCC1

InChI

InChI=1S/C17H25N3O2S/c21-15(18-12-7-3-1-2-4-8-12)14-11-23-17(20-14)16(22)19-13-9-5-6-10-13/h11-13H,1-10H2,(H,18,21)(H,19,22)

InChI Key

WKFWCFWSSVETNC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27561098

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.861

Distribution Coefficient, logD

3.861

Water Solubility, LogSw

-3.85

Polar Surface Area

59.218

Acid Dissociation Constant (pKa)

13.21

Base Dissociation Constant (pKb)

-1.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

70.60

P053-3027 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P053-3027 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P053-3027?
Check Price and Availability of P053-3027, 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 P053-3027 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P053-3027
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P053-3027
  • 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 P053-3027 available by request