V008-7325 Screening compound: 5-(4-fluoro-3-methylphenyl)-2-[1-(3-nitrobenzoyl)pyrrolidin-2-yl]-1,3-benzoxazole

V008-7325 Screening compound: 5-(4-fluoro-3-methylphenyl)-2-[1-(3-nitrobenzoyl)pyrrolidin-2-yl]-1,3-benzoxazole
V008-7325 Screening compound: 5-(4-fluoro-3-methylphenyl)-2-[1-(3-nitrobenzoyl)pyrrolidin-2-yl]-1,3-benzoxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-7325
5-(4-fluoro-3-methylphenyl)-2-[1-(3-nitrobenzoyl)pyrrolidin-2-yl]-1,3-benzoxazole

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

V008-7325

Molecular Formula

C25H20FN3O4 (C25 H20 FN3 O4)

Compound Name

5-(4-fluoro-3-methylphenyl)-2-[1-(3-nitrobenzoyl)pyrrolidin-2-yl]-1,3-benzoxazole

IUPAC name

5-(4-fluoro-3-methylphenyl)-2-[1-(3-nitrobenzoyl)pyrrolidin-2-yl]-13-benzoxazole

SMILES

Cc(cc(cc1)-c(cc2)cc3c2oc(C(CCC2)N2C(c2cc([N+]([O-])=O)ccc2)=O)n3)c1F

InChI

InChI=1S/C25H20FN3O4/c1-15-12-16(7-9-20(15)26)17-8-10-23-21(14-17)27-24(33-23)22-6-3-11-28(22)25(30)18-4-2-5-19(13-18)29(31)32/h2,4-5,7-10,12-14,22H,3,6,11H2,1H3/t22-/m0/s1

InChI Key

IDCYENLORMSURR-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19969499

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.496

Distribution Coefficient, logD

5.496

Water Solubility, LogSw

-5.45

Polar Surface Area

66.867

Acid Dissociation Constant (pKa)

26.97

Base Dissociation Constant (pKb)

-3.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

V008-7325 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V008-7325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-7325?
Check Price and Availability of V008-7325, 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 V008-7325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-7325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-7325
  • 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 V008-7325 available by request