D434-0001 Screening compound: 1-benzoyl-4-{5,7-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperazine

D434-0001 Screening compound: 1-benzoyl-4-{5,7-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperazine
D434-0001 Screening compound: 1-benzoyl-4-{5,7-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D434-0001
1-benzoyl-4-{5,7-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperazine

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

D434-0001

Molecular Formula

C29H25N5O (C29 H25 N5 O)

Compound Name

1-benzoyl-4-{5,7-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperazine

IUPAC name

1-benzoyl-4-{57-diphenyl-7H-pyrrolo[23-d]pyrimidin-4-yl}piperazine

SMILES

O=C(c1ccccc1)N(CC1)CCN1c1ncnc2c1c(-c1ccccc1)cn2-c1ccccc1

InChI

InChI=1S/C29H25N5O/c35-29(23-12-6-2-7-13-23)33-18-16-32(17-19-33)27-26-25(22-10-4-1-5-11-22)20-34(28(26)31-21-30-27)24-14-8-3-9-15-24/h1-15,20-21H,16-19H2

InChI Key

JQNNLMUXFVYJJX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09762590

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.55

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

5.216

Distribution Coefficient, logD

5.108

Water Solubility, LogSw

-5.36

Polar Surface Area

42.668

Acid Dissociation Constant (pKa)

22.46

Base Dissociation Constant (pKb)

6.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.80

D434-0001 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D434-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D434-0001?
Check Price and Availability of D434-0001, 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 D434-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D434-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D434-0001
  • 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 D434-0001 available by request