P053-2995 Screening compound: N-cyclopentyl-4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,3-thiazole-2-carboxamide

P053-2995 Screening compound: N-cyclopentyl-4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,3-thiazole-2-carboxamide
P053-2995 Screening compound: N-cyclopentyl-4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,3-thiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P053-2995
N-cyclopentyl-4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-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

P053-2995

Molecular Formula

C22H28N4O2S (C22 H28 N4 O2 S)

Compound Name

N-cyclopentyl-4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,3-thiazole-2-carboxamide

IUPAC name

N-cyclopentyl-4-[4-(23-dimethylphenyl)piperazine-1-carbonyl]-13-thiazole-2-carboxamide

SMILES

Cc1cccc(N(CC2)CCN2C(c2csc(C(NC3CCCC3)=O)n2)=O)c1C

InChI

InChI=1S/C22H28N4O2S/c1-15-6-5-9-19(16(15)2)25-10-12-26(13-11-25)22(28)18-14-29-21(24-18)20(27)23-17-7-3-4-8-17/h5-6,9,14,17H,3-4,7-8,10-13H2,1-2H3,(H,23,27)

InChI Key

HGMIAHYVCMCVEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27561083

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.332

Distribution Coefficient, logD

4.332

Water Solubility, LogSw

-4.19

Polar Surface Area

54.356

Acid Dissociation Constant (pKa)

14.45

Base Dissociation Constant (pKb)

2.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

P053-2995 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P053-2995 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P053-2995?
Check Price and Availability of P053-2995, 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 P053-2995 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P053-2995
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P053-2995
  • 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 P053-2995 available by request