Y031-7122 Screening compound: 1-(tert-butyl)-N-(6-methyl-2-pyridyl)-5-oxo-3-pyrrolidinecarboxamide

Y031-7122 Screening compound: 1-(tert-butyl)-N-(6-methyl-2-pyridyl)-5-oxo-3-pyrrolidinecarboxamide
Y031-7122 Screening compound: 1-(tert-butyl)-N-(6-methyl-2-pyridyl)-5-oxo-3-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-7122
1-(tert-butyl)-N-(6-methyl-2-pyridyl)-5-oxo-3-pyrrolidinecarboxamide

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

Y031-7122

Molecular Formula

C15H21N3O2 (C15 H21 N3 O2)

Compound Name

1-(tert-butyl)-N-(6-methyl-2-pyridyl)-5-oxo-3-pyrrolidinecarboxamide

IUPAC name

1-tert-butyl-N-(6-methylpyridin-2-yl)-5-oxopyrrolidine-3-carboxamide

SMILES

CC(C)(C)N(CC(C1)C(Nc2nc(C)ccc2)=O)C1=O

InChI

InChI=1S/C15H21N3O2/c1-10-6-5-7-12(16-10)17-14(20)11-8-13(19)18(9-11)15(2,3)4/h5-7,11H,8-9H2,1-4H3,(H,16,17,20)/t11-/m1/s1

InChI Key

YIOXECRTSRCZGN-LLVKDONJSA-N

MDL Number (MFCD)

MFCD06735959

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

275.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.518

Distribution Coefficient, logD

1.517

Water Solubility, LogSw

-1.81

Polar Surface Area

50.036

Acid Dissociation Constant (pKa)

10.21

Base Dissociation Constant (pKb)

4.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.33

Y031-7122 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with Y031-7122 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-7122?
Check Price and Availability of Y031-7122, 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 Y031-7122 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-7122
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-7122
  • 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 Y031-7122 available by request