4606-3748 Screening compound: 2,2-dimethyl-N-(pyrimidin-2-yl)propanamide

4606-3748 Screening compound: 2,2-dimethyl-N-(pyrimidin-2-yl)propanamide
4606-3748 Screening compound: 2,2-dimethyl-N-(pyrimidin-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4606-3748
2,2-dimethyl-N-(pyrimidin-2-yl)propanamide

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

4606-3748

Molecular Formula

C9H13N3O (C9 H13 N3 O)

Compound Name

2,2-dimethyl-N-(pyrimidin-2-yl)propanamide

IUPAC name

22-dimethyl-N-(pyrimidin-2-yl)propanamide

SMILES

CC(C)(C)C(Nc1ncccn1)=O

InChI

InChI=1S/C9H13N3O/c1-9(2,3)7(13)12-8-10-5-4-6-11-8/h4-6H,1-3H3,(H,10,11,12,13)

InChI Key

FDSDCQFFMLXXFA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00838285

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

179.22

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.698

Distribution Coefficient, logD

0.692

Water Solubility, LogSw

-1.74

Polar Surface Area

44.171

Acid Dissociation Constant (pKa)

9.26

Base Dissociation Constant (pKb)

0.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

4606-3748 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 4606-3748 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4606-3748?
Check Price and Availability of 4606-3748, 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 4606-3748 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4606-3748
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4606-3748
  • 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 4606-3748 available by request