V003-9824 Screening compound: 4-methyl-6-[4-(oxolane-3-carbonyl)piperazin-1-yl]-2-phenyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine

V003-9824 Screening compound: 4-methyl-6-[4-(oxolane-3-carbonyl)piperazin-1-yl]-2-phenyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
V003-9824 Screening compound: 4-methyl-6-[4-(oxolane-3-carbonyl)piperazin-1-yl]-2-phenyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-9824
4-methyl-6-[4-(oxolane-3-carbonyl)piperazin-1-yl]-2-phenyl-5-{[3-(trifluoromethyl)phenyl]methyl}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

V003-9824

Molecular Formula

C28H29F3N4O2 (C28 H29 F3 N4 O2)

Compound Name

4-methyl-6-[4-(oxolane-3-carbonyl)piperazin-1-yl]-2-phenyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine

IUPAC name

4-methyl-6-[4-(oxolane-3-carbonyl)piperazin-1-yl]-2-phenyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine

SMILES

Cc1nc(-c2ccccc2)nc(N(CC2)CCN2C(C2COCC2)=O)c1Cc1cccc(C(F)(F)F)c1

InChI

InChI=1S/C28H29F3N4O2/c1-19-24(17-20-6-5-9-23(16-20)28(29,30)31)26(33-25(32-19)21-7-3-2-4-8-21)34-11-13-35(14-12-34)27(36)22-10-15-37-18-22/h2-9,16,22H,10-15,17-18H2,1H3/t22-/m0/s1

InChI Key

DHOUGRPKHNCWDW-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19784915

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

510.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.791

Distribution Coefficient, logD

5.716

Water Solubility, LogSw

-5.69

Polar Surface Area

47.650

Acid Dissociation Constant (pKa)

20.84

Base Dissociation Constant (pKb)

6.68

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.30

V003-9824 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V003-9824 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-9824?
Check Price and Availability of V003-9824, 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 V003-9824 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-9824
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-9824
  • 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 V003-9824 available by request