P471-0068 Screening compound: N-(4-{5-methyl-4-[(1H-pyrazol-1-yl)methyl]-1,3-oxazol-2-yl}phenyl)cyclopropanecarboxamide

P471-0068 Screening compound: N-(4-{5-methyl-4-[(1H-pyrazol-1-yl)methyl]-1,3-oxazol-2-yl}phenyl)cyclopropanecarboxamide
P471-0068 Screening compound: N-(4-{5-methyl-4-[(1H-pyrazol-1-yl)methyl]-1,3-oxazol-2-yl}phenyl)cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P471-0068
N-(4-{5-methyl-4-[(1H-pyrazol-1-yl)methyl]-1,3-oxazol-2-yl}phenyl)cyclopropanecarboxamide

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

P471-0068

Molecular Formula

C18H18N4O2 (C18 H18 N4 O2)

Compound Name

N-(4-{5-methyl-4-[(1H-pyrazol-1-yl)methyl]-1,3-oxazol-2-yl}phenyl)cyclopropanecarboxamide

IUPAC name

N-(4-{5-methyl-4-[(1H-pyrazol-1-yl)methyl]-13-oxazol-2-yl}phenyl)cyclopropanecarboxamide

SMILES

Cc1c(Cn2nccc2)nc(-c(cc2)ccc2NC(C2CC2)=O)o1

InChI

InChI=1S/C18H18N4O2/c1-12-16(11-22-10-2-9-19-22)21-18(24-12)14-5-7-15(8-6-14)20-17(23)13-3-4-13/h2,5-10,13H,3-4,11H2,1H3,(H,20,23)

InChI Key

RMKVDHJWJNYCIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27575548

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.336

Distribution Coefficient, logD

2.336

Water Solubility, LogSw

-2.85

Polar Surface Area

56.498

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

2.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

P471-0068 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P471-0068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P471-0068?
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What is the minimum amount of P471-0068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P471-0068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P471-0068
  • 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 P471-0068 available by request