T404-0783 Screening compound: 1-(4-ethylbenzoyl)-4-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}-1,4-diazepane

T404-0783 Screening compound: 1-(4-ethylbenzoyl)-4-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}-1,4-diazepane
T404-0783 Screening compound: 1-(4-ethylbenzoyl)-4-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound T404-0783
1-(4-ethylbenzoyl)-4-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}-1,4-diazepane

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

T404-0783

Molecular Formula

C20H23N5O (C20 H23 N5 O)

Compound Name

1-(4-ethylbenzoyl)-4-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}-1,4-diazepane

IUPAC name

1-(4-ethylbenzoyl)-4-{[124]triazolo[43-a]pyridin-3-yl}-14-diazepane

SMILES

CCc(cc1)ccc1C(N(CCC1)CCN1c1nnc2n1cccc2)=O

InChI

InChI=1S/C20H23N5O/c1-2-16-7-9-17(10-8-16)19(26)23-11-5-12-24(15-14-23)20-22-21-18-6-3-4-13-25(18)20/h3-4,6-10,13H,2,5,11-12,14-15H2,1H3

InChI Key

MCQVCYSHWOLSGZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28121280

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.625

Distribution Coefficient, logD

2.625

Water Solubility, LogSw

-2.62

Polar Surface Area

41.629

Acid Dissociation Constant (pKa)

22.73

Base Dissociation Constant (pKb)

7.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with T404-0783 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T404-0783?
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What is the minimum amount of T404-0783 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T404-0783
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T404-0783
  • 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 T404-0783 available by request