V003-4991 Screening compound: 5-(naphthalen-2-yl)-3-(pyrrolidine-1-carbonyl)-1,2-oxazole

V003-4991 Screening compound: 5-(naphthalen-2-yl)-3-(pyrrolidine-1-carbonyl)-1,2-oxazole
V003-4991 Screening compound: 5-(naphthalen-2-yl)-3-(pyrrolidine-1-carbonyl)-1,2-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-4991
5-(naphthalen-2-yl)-3-(pyrrolidine-1-carbonyl)-1,2-oxazole

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

V003-4991

Molecular Formula

C18H16N2O2 (C18 H16 N2 O2)

Compound Name

5-(naphthalen-2-yl)-3-(pyrrolidine-1-carbonyl)-1,2-oxazole

IUPAC name

5-(naphthalen-2-yl)-3-(pyrrolidine-1-carbonyl)-12-oxazole

SMILES

O=C(c1noc(-c2cc3ccccc3cc2)c1)N1CCCC1

InChI

InChI=1S/C18H16N2O2/c21-18(20-9-3-4-10-20)16-12-17(22-19-16)15-8-7-13-5-1-2-6-14(13)11-15/h1-2,5-8,11-12H,3-4,9-10H2

InChI Key

JKJXCHAZHFPRQH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19954881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.956

Distribution Coefficient, logD

3.956

Water Solubility, LogSw

-4.14

Polar Surface Area

38.516

Acid Dissociation Constant (pKa)

28.00

Base Dissociation Constant (pKb)

-5.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with V003-4991 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-4991?
Check Price and Availability of V003-4991, 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 V003-4991 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-4991
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-4991
  • 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 V003-4991 available by request