D430-0095 Screening compound: 2-methyl-4-(pyrrolidin-1-yl)-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine

D430-0095 Screening compound: 2-methyl-4-(pyrrolidin-1-yl)-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine
D430-0095 Screening compound: 2-methyl-4-(pyrrolidin-1-yl)-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound D430-0095
2-methyl-4-(pyrrolidin-1-yl)-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine

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

D430-0095

Molecular Formula

C21H24F3N5O (C21 H24 F3 N5 O)

Compound Name

2-methyl-4-(pyrrolidin-1-yl)-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine

IUPAC name

2-methyl-4-(pyrrolidin-1-yl)-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine

SMILES

Cc1nc(N2CCCC2)cc(N(CC2)CCN2C(c2cccc(C(F)(F)F)c2)=O)n1

InChI

InChI=1S/C21H24F3N5O/c1-15-25-18(27-7-2-3-8-27)14-19(26-15)28-9-11-29(12-10-28)20(30)16-5-4-6-17(13-16)21(22,23)24/h4-6,13-14H,2-3,7-12H2,1H3

InChI Key

MSEUIRCPELBISB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14828332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.090

Distribution Coefficient, logD

4.067

Water Solubility, LogSw

-4.28

Polar Surface Area

41.076

Acid Dissociation Constant (pKa)

21.94

Base Dissociation Constant (pKb)

6.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

D430-0095 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with D430-0095 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D430-0095?
Check Price and Availability of D430-0095, 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 D430-0095 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D430-0095
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D430-0095
  • 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 D430-0095 available by request