T750-1540 Screening compound: 1-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]azepane

T750-1540 Screening compound: 1-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]azepane
T750-1540 Screening compound: 1-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound T750-1540
1-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]azepane

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

T750-1540

Molecular Formula

C14H18N4 (C14 H18 N4)

Compound Name

1-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]azepane

IUPAC name

1-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]azepane

SMILES

C(CCC1)CCN1c1cc(-c2ccncc2)n[nH]1

InChI

InChI=1S/C14H18N4/c1-2-4-10-18(9-3-1)14-11-13(16-17-14)12-5-7-15-8-6-12/h5-8,11H,1-4,9-10H2,(H,16,17)

InChI Key

GZAYJXZXLYYXBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27623315

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

242.32

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.831

Distribution Coefficient, logD

2.830

Water Solubility, LogSw

-2.97

Polar Surface Area

35.403

Acid Dissociation Constant (pKa)

15.04

Base Dissociation Constant (pKb)

4.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.86

T750-1540 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with T750-1540 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T750-1540?
Check Price and Availability of T750-1540, 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 T750-1540 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T750-1540
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T750-1540
  • 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 T750-1540 available by request