V016-2412 Screening compound: N-tert-butyl-5-oxo-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxamide

V016-2412 Screening compound: N-tert-butyl-5-oxo-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxamide
V016-2412 Screening compound: N-tert-butyl-5-oxo-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-2412
N-tert-butyl-5-oxo-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxamide

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

V016-2412

Molecular Formula

C18H26N2O2 (C18 H26 N2 O2)

Compound Name

N-tert-butyl-5-oxo-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxamide

IUPAC name

N-tert-butyl-5-oxo-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxamide

SMILES

CC(C)c(cc1)ccc1N(CC(C1)C(NC(C)(C)C)=O)C1=O

InChI

InChI=1S/C18H26N2O2/c1-12(2)13-6-8-15(9-7-13)20-11-14(10-16(20)21)17(22)19-18(3,4)5/h6-9,12,14H,10-11H2,1-5H3,(H,19,22)/t14-/m1/s1

InChI Key

MALGMNBKAIWYHR-CQSZACIVSA-N

MDL Number (MFCD)

MFCD19972147

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.261

Distribution Coefficient, logD

3.261

Water Solubility, LogSw

-3.15

Polar Surface Area

40.497

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

0.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.60

V016-2412 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V016-2412 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-2412?
Check Price and Availability of V016-2412, 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 V016-2412 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-2412
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-2412
  • 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 V016-2412 available by request