D430-0200 Screening compound: 4-{2-methyl-6-[4-(3-nitrobenzoyl)piperazin-1-yl]pyrimidin-4-yl}morpholine

D430-0200 Screening compound: 4-{2-methyl-6-[4-(3-nitrobenzoyl)piperazin-1-yl]pyrimidin-4-yl}morpholine
D430-0200 Screening compound: 4-{2-methyl-6-[4-(3-nitrobenzoyl)piperazin-1-yl]pyrimidin-4-yl}morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound D430-0200
4-{2-methyl-6-[4-(3-nitrobenzoyl)piperazin-1-yl]pyrimidin-4-yl}morpholine

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

D430-0200

Molecular Formula

C20H24N6O4 (C20 H24 N6 O4)

Compound Name

4-{2-methyl-6-[4-(3-nitrobenzoyl)piperazin-1-yl]pyrimidin-4-yl}morpholine

IUPAC name

4-{2-methyl-6-[4-(3-nitrobenzoyl)piperazin-1-yl]pyrimidin-4-yl}morpholine

SMILES

Cc1nc(N2CCOCC2)cc(N(CC2)CCN2C(c2cccc([N+]([O-])=O)c2)=O)n1

InChI

InChI=1S/C20H24N6O4/c1-15-21-18(14-19(22-15)24-9-11-30-12-10-24)23-5-7-25(8-6-23)20(27)16-3-2-4-17(13-16)26(28)29/h2-4,13-14H,5-12H2,1H3

InChI Key

YKUWYYGKODSBSD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14828366

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.509

Distribution Coefficient, logD

2.483

Water Solubility, LogSw

-2.57

Polar Surface Area

82.001

Acid Dissociation Constant (pKa)

23.11

Base Dissociation Constant (pKb)

6.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

D430-0200 in Drug Discovery

Included in Screening Libraries

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

PI3K-Targeted Library (17255 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D430-0200 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D430-0200?
Check Price and Availability of D430-0200, 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 D430-0200 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D430-0200
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D430-0200
  • 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 D430-0200 available by request