P708-1250 Screening compound: 1-{1-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}azepane

P708-1250 Screening compound: 1-{1-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}azepane
P708-1250 Screening compound: 1-{1-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound P708-1250
1-{1-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}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

P708-1250

Molecular Formula

C22H28N6O2 (C22 H28 N6 O2)

Compound Name

1-{1-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}azepane

IUPAC name

1-{1-[4-(3-tert-butyl-124-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}azepane

SMILES

CC(C)(C)c1noc(-c2cc(-n3ncc(C(N4CCCCCC4)=O)c3C)ncc2)n1

InChI

InChI=1S/C22H28N6O2/c1-15-17(20(29)27-11-7-5-6-8-12-27)14-24-28(15)18-13-16(9-10-23-18)19-25-21(26-30-19)22(2,3)4/h9-10,13-14H,5-8,11-12H2,1-4H3

InChI Key

OPPPAJKXBGALNL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27613313

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.448

Distribution Coefficient, logD

4.448

Water Solubility, LogSw

-4.21

Polar Surface Area

71.471

Acid Dissociation Constant (pKa)

26.43

Base Dissociation Constant (pKb)

2.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with P708-1250 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P708-1250?
Check Price and Availability of P708-1250, 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 P708-1250 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P708-1250
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P708-1250
  • 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 P708-1250 available by request