T040-0670 Screening compound: ethyl 4-{3-[2-(diethylamino)pyridin-4-yl]propanoyl}piperazine-1-carboxylate

T040-0670 Screening compound: ethyl 4-{3-[2-(diethylamino)pyridin-4-yl]propanoyl}piperazine-1-carboxylate
T040-0670 Screening compound: ethyl 4-{3-[2-(diethylamino)pyridin-4-yl]propanoyl}piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound T040-0670
ethyl 4-{3-[2-(diethylamino)pyridin-4-yl]propanoyl}piperazine-1-carboxylate

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

T040-0670

Molecular Formula

C19H30N4O3 (C19 H30 N4 O3)

Compound Name

ethyl 4-{3-[2-(diethylamino)pyridin-4-yl]propanoyl}piperazine-1-carboxylate

IUPAC name

ethyl 4-{3-[2-(diethylamino)pyridin-4-yl]propanoyl}piperazine-1-carboxylate

SMILES

CCN(CC)c1nccc(CCC(N(CC2)CCN2C(OCC)=O)=O)c1

InChI

InChI=1S/C19H30N4O3/c1-4-21(5-2)17-15-16(9-10-20-17)7-8-18(24)22-11-13-23(14-12-22)19(25)26-6-3/h9-10,15H,4-8,11-14H2,1-3H3

InChI Key

GZQDYFBOJDQTOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27618435

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.421

Distribution Coefficient, logD

2.201

Water Solubility, LogSw

-2.49

Polar Surface Area

50.387

Acid Dissociation Constant (pKa)

23.39

Base Dissociation Constant (pKb)

7.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.20

T040-0670 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with T040-0670 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T040-0670?
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What is the minimum amount of T040-0670 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T040-0670
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T040-0670
  • 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 T040-0670 available by request