T040-0853 Screening compound: 3-[2-(diethylamino)pyridin-4-yl]-1-[4-(4-methylphenyl)piperazin-1-yl]propan-1-one

T040-0853 Screening compound: 3-[2-(diethylamino)pyridin-4-yl]-1-[4-(4-methylphenyl)piperazin-1-yl]propan-1-one
T040-0853 Screening compound: 3-[2-(diethylamino)pyridin-4-yl]-1-[4-(4-methylphenyl)piperazin-1-yl]propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T040-0853
3-[2-(diethylamino)pyridin-4-yl]-1-[4-(4-methylphenyl)piperazin-1-yl]propan-1-one

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

T040-0853

Molecular Formula

C23H32N4O (C23 H32 N4 O)

Compound Name

3-[2-(diethylamino)pyridin-4-yl]-1-[4-(4-methylphenyl)piperazin-1-yl]propan-1-one

IUPAC name

3-[2-(diethylamino)pyridin-4-yl]-1-[4-(4-methylphenyl)piperazin-1-yl]propan-1-one

SMILES

CCN(CC)c1nccc(CCC(N(CC2)CCN2c2ccc(C)cc2)=O)c1

InChI

InChI=1S/C23H32N4O/c1-4-25(5-2)22-18-20(12-13-24-22)8-11-23(28)27-16-14-26(15-17-27)21-9-6-19(3)7-10-21/h6-7,9-10,12-13,18H,4-5,8,11,14-17H2,1-3H3

InChI Key

HILCGVCUEBBCTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27618530

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.53

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.064

Distribution Coefficient, logD

3.844

Water Solubility, LogSw

-3.93

Polar Surface Area

30.867

Acid Dissociation Constant (pKa)

23.39

Base Dissociation Constant (pKb)

7.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

References: we are preparing a list of scientific research reports with T040-0853 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T040-0853?
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What is the minimum amount of T040-0853 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T040-0853
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T040-0853
  • 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 T040-0853 available by request