V002-9957 Screening compound: N-benzyl-N-{[5-(3,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl}-3-methylbutanamide

V002-9957 Screening compound: N-benzyl-N-{[5-(3,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl}-3-methylbutanamide
V002-9957 Screening compound: N-benzyl-N-{[5-(3,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl}-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-9957
N-benzyl-N-{[5-(3,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl}-3-methylbutanamide

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

V002-9957

Molecular Formula

C24H28N2O2 (C24 H28 N2 O2)

Compound Name

N-benzyl-N-{[5-(3,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl}-3-methylbutanamide

IUPAC name

N-benzyl-N-{[5-(34-dimethylphenyl)-12-oxazol-3-yl]methyl}-3-methylbutanamide

SMILES

CC(C)CC(N(Cc1noc(-c2cc(C)c(C)cc2)c1)Cc1ccccc1)=O

InChI

InChI=1S/C24H28N2O2/c1-17(2)12-24(27)26(15-20-8-6-5-7-9-20)16-22-14-23(28-25-22)21-11-10-18(3)19(4)13-21/h5-11,13-14,17H,12,15-16H2,1-4H3

InChI Key

OUUVTCWVPDDTGY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19810611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.682

Distribution Coefficient, logD

5.682

Water Solubility, LogSw

-5.49

Polar Surface Area

37.953

Acid Dissociation Constant (pKa)

23.65

Base Dissociation Constant (pKb)

-4.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

V002-9957 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V002-9957 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-9957?
Check Price and Availability of V002-9957, 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 V002-9957 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-9957
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-9957
  • 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 V002-9957 available by request