P642-0925 Screening compound: 3-[2-(azepan-1-yl)pyridin-4-yl]-N-[(oxolan-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide

P642-0925 Screening compound: 3-[2-(azepan-1-yl)pyridin-4-yl]-N-[(oxolan-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
P642-0925 Screening compound: 3-[2-(azepan-1-yl)pyridin-4-yl]-N-[(oxolan-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P642-0925
3-[2-(azepan-1-yl)pyridin-4-yl]-N-[(oxolan-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide

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

P642-0925

Molecular Formula

C19H25N5O3 (C19 H25 N5 O3)

Compound Name

3-[2-(azepan-1-yl)pyridin-4-yl]-N-[(oxolan-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide

IUPAC name

3-[2-(azepan-1-yl)pyridin-4-yl]-N-[(oxolan-2-yl)methyl]-124-oxadiazole-5-carboxamide

SMILES

O=C(c1nc(-c2cc(N3CCCCCC3)ncc2)no1)NCC1OCCC1

InChI

InChI=1S/C19H25N5O3/c25-18(21-13-15-6-5-11-26-15)19-22-17(23-27-19)14-7-8-20-16(12-14)24-9-3-1-2-4-10-24/h7-8,12,15H,1-6,9-11,13H2,(H,21,25)/t15-/m1/s1

InChI Key

HPNSESSDYQBWHR-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD27608925

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.015

Distribution Coefficient, logD

3.008

Water Solubility, LogSw

-3.26

Polar Surface Area

77.278

Acid Dissociation Constant (pKa)

13.02

Base Dissociation Constant (pKb)

5.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.90

P642-0925 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P642-0925 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P642-0925?
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What is the minimum amount of P642-0925 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P642-0925
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P642-0925
  • 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 P642-0925 available by request