T040-0752 Screening compound: 3-[2-(diethylamino)pyridin-4-yl]-N-(2-methylpropyl)propanamide

T040-0752 Screening compound: 3-[2-(diethylamino)pyridin-4-yl]-N-(2-methylpropyl)propanamide
T040-0752 Screening compound: 3-[2-(diethylamino)pyridin-4-yl]-N-(2-methylpropyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T040-0752
3-[2-(diethylamino)pyridin-4-yl]-N-(2-methylpropyl)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

T040-0752

Molecular Formula

C16H27N3O (C16 H27 N3 O)

Compound Name

3-[2-(diethylamino)pyridin-4-yl]-N-(2-methylpropyl)propanamide

IUPAC name

3-[2-(diethylamino)pyridin-4-yl]-N-(2-methylpropyl)propanamide

SMILES

CCN(CC)c1nccc(CCC(NCC(C)C)=O)c1

InChI

InChI=1S/C16H27N3O/c1-5-19(6-2)15-11-14(9-10-17-15)7-8-16(20)18-12-13(3)4/h9-11,13H,5-8,12H2,1-4H3,(H,18,20)

InChI Key

QZYTYNMILXXVCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28121213

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

277.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.781

Distribution Coefficient, logD

2.561

Water Solubility, LogSw

-3.18

Polar Surface Area

35.957

Acid Dissociation Constant (pKa)

15.51

Base Dissociation Constant (pKb)

7.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

T040-0752 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with T040-0752 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T040-0752?
Check Price and Availability of T040-0752, 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 T040-0752 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T040-0752
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T040-0752
  • 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 T040-0752 available by request