V008-4506 Screening compound: 2-{5-methyl-2-[3-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}-1-{2-[4-(morpholine-4-carbonyl)piperidine-1-carbonyl]pyrrolidin-1-yl}ethan-1-one

V008-4506 Screening compound: 2-{5-methyl-2-[3-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}-1-{2-[4-(morpholine-4-carbonyl)piperidine-1-carbonyl]pyrrolidin-1-yl}ethan-1-one
V008-4506 Screening compound: 2-{5-methyl-2-[3-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}-1-{2-[4-(morpholine-4-carbonyl)piperidine-1-carbonyl]pyrrolidin-1-yl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-4506
2-{5-methyl-2-[3-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}-1-{2-[4-(morpholine-4-carbonyl)piperidine-1-carbonyl]pyrrolidin-1-yl}ethan-1-one

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

V008-4506

Molecular Formula

C28H33F3N4O5 (C28 H33 F3 N4 O5)

Compound Name

2-{5-methyl-2-[3-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}-1-{2-[4-(morpholine-4-carbonyl)piperidine-1-carbonyl]pyrrolidin-1-yl}ethan-1-one

IUPAC name

n/a

SMILES

Cc1c(CC(N(CCC2)[C@@H]2C(N(CC2)CCC2C(N2CCOCC2)=O)=O)=O)nc(-c2cccc(C(F)(F)F)c2)o1

InChI

InChI=1S/C28H33F3N4O5/c1-18-22(32-25(40-18)20-4-2-5-21(16-20)28(29,30)31)17-24(36)35-9-3-6-23(35)27(38)33-10-7-19(8-11-33)26(37)34-12-14-39-15-13-34/h2,4-5,16,19,23H,3,6-15,17H2,1H3/t23-/m0/s1

InChI Key

HLSCSAYBOZFOGO-QHCPKHFHSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

562.59

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.031

Distribution Coefficient, logD

2.031

Water Solubility, LogSw

-2.30

Polar Surface Area

75.746

Acid Dissociation Constant (pKa)

20.60

Base Dissociation Constant (pKb)

1.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.10

V008-4506 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Anti-HIV1 Library (19540 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V008-4506 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-4506?
Check Price and Availability of V008-4506, 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 V008-4506 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-4506
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-4506
  • 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 V008-4506 available by request