P708-0711 Screening compound: 4-{5-methyl-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1H-pyrazole-4-carbonyl}thiomorpholine

P708-0711 Screening compound: 4-{5-methyl-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1H-pyrazole-4-carbonyl}thiomorpholine
P708-0711 Screening compound: 4-{5-methyl-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1H-pyrazole-4-carbonyl}thiomorpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound P708-0711
4-{5-methyl-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1H-pyrazole-4-carbonyl}thiomorpholine

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

P708-0711

Molecular Formula

C19H22N6O2S (C19 H22 N6 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CCCc1noc(-c2cc(-n3ncc(C(N4CCSCC4)=O)c3C)ncc2)n1

InChI

InChI=1S/C19H22N6O2S/c1-3-4-16-22-18(27-23-16)14-5-6-20-17(11-14)25-13(2)15(12-21-25)19(26)24-7-9-28-10-8-24/h5-6,11-12H,3-4,7-10H2,1-2H3

InChI Key

WNQMHTUSLPDXRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27613265

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.927

Distribution Coefficient, logD

2.927

Water Solubility, LogSw

-3.13

Polar Surface Area

72.131

Acid Dissociation Constant (pKa)

26.43

Base Dissociation Constant (pKb)

2.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

P708-0711 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P708-0711 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P708-0711?
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What is the minimum amount of P708-0711 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P708-0711
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P708-0711
  • 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 P708-0711 available by request