T629-2349 Screening compound: 1-[3-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)piperidino]-2-(2-methoxyphenoxy)-1-ethanone

T629-2349 Screening compound: 1-[3-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)piperidino]-2-(2-methoxyphenoxy)-1-ethanone
T629-2349 Screening compound: 1-[3-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)piperidino]-2-(2-methoxyphenoxy)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound T629-2349
1-[3-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)piperidino]-2-(2-methoxyphenoxy)-1-ethanone

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

T629-2349

Molecular Formula

C19H24N4O3 (C19 H24 N4 O3)

Compound Name

1-[3-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)piperidino]-2-(2-methoxyphenoxy)-1-ethanone

IUPAC name

n/a

SMILES

COc(cccc1)c1OCC(N(CCC1)CC1c1nnc(C2CC2)[nH]1)=O

InChI

InChI=1S/C19H24N4O3/c1-25-15-6-2-3-7-16(15)26-12-17(24)23-10-4-5-14(11-23)19-20-18(21-22-19)13-8-9-13/h2-3,6-7,13-14H,4-5,8-12H2,1H3,(H,20,21,22)/t14-/m0/s1

InChI Key

QTKJDDXXNLPJFF-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27622566

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.328

Distribution Coefficient, logD

1.320

Water Solubility, LogSw

-1.81

Polar Surface Area

65.545

Acid Dissociation Constant (pKa)

9.89

Base Dissociation Constant (pKb)

7.70

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.60

T629-2349 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T629-2349 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T629-2349?
Check Price and Availability of T629-2349, 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 T629-2349 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T629-2349
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T629-2349
  • 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 T629-2349 available by request