V003-9620 Screening compound: 2-(4-{4-[4-(morpholin-4-yl)phenyl]pyrimidin-2-yl}piperazin-1-yl)-2-oxo-1-phenylethyl acetate

V003-9620 Screening compound: 2-(4-{4-[4-(morpholin-4-yl)phenyl]pyrimidin-2-yl}piperazin-1-yl)-2-oxo-1-phenylethyl acetate
V003-9620 Screening compound: 2-(4-{4-[4-(morpholin-4-yl)phenyl]pyrimidin-2-yl}piperazin-1-yl)-2-oxo-1-phenylethyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-9620
2-(4-{4-[4-(morpholin-4-yl)phenyl]pyrimidin-2-yl}piperazin-1-yl)-2-oxo-1-phenylethyl acetate

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

V003-9620

Molecular Formula

C28H31N5O4 (C28 H31 N5 O4)

Compound Name

2-(4-{4-[4-(morpholin-4-yl)phenyl]pyrimidin-2-yl}piperazin-1-yl)-2-oxo-1-phenylethyl acetate

IUPAC name

2-(4-{4-[4-(morpholin-4-yl)phenyl]pyrimidin-2-yl}piperazin-1-yl)-2-oxo-1-phenylethyl acetate

SMILES

CC(OC(C(N(CC1)CCN1c1nc(-c(cc2)ccc2N2CCOCC2)ccn1)=O)c1ccccc1)=O

InChI

InChI=1S/C28H31N5O4/c1-21(34)37-26(23-5-3-2-4-6-23)27(35)32-13-15-33(16-14-32)28-29-12-11-25(30-28)22-7-9-24(10-8-22)31-17-19-36-20-18-31/h2-12,26H,13-20H2,1H3/t26-/m1/s1

InChI Key

LKGQEDGGWGIQAP-AREMUKBSSA-N

MDL Number (MFCD)

MFCD19943875

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

501.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.669

Distribution Coefficient, logD

3.669

Water Solubility, LogSw

-3.74

Polar Surface Area

69.674

Acid Dissociation Constant (pKa)

21.15

Base Dissociation Constant (pKb)

3.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

V003-9620 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V003-9620 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-9620?
Check Price and Availability of V003-9620, 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 V003-9620 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-9620
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-9620
  • 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 V003-9620 available by request