SA87-0588 Screening compound: 5-cyclopropyl-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}-1H-pyrazole-3-carboxamide

SA87-0588 Screening compound: 5-cyclopropyl-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}-1H-pyrazole-3-carboxamide
SA87-0588 Screening compound: 5-cyclopropyl-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}-1H-pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA87-0588
5-cyclopropyl-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}-1H-pyrazole-3-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

SA87-0588

Molecular Formula

C16H24N4O3 (C16 H24 N4 O3)

Compound Name

5-cyclopropyl-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}-1H-pyrazole-3-carboxamide

IUPAC name

5-cyclopropyl-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}-1H-pyrazole-3-carboxamide

SMILES

CC(C)CN(CC(CNC(c1n[nH]c(C2CC2)c1)=O)OC1)C1=O

InChI

InChI=1S/C16H24N4O3/c1-10(2)7-20-8-12(23-9-15(20)21)6-17-16(22)14-5-13(18-19-14)11-3-4-11/h5,10-12H,3-4,6-9H2,1-2H3,(H,17,22)(H,18,19)/t12-/m1/s1

InChI Key

JKHGLZYCLXNRNQ-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD32243038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.060

Distribution Coefficient, logD

1.060

Water Solubility, LogSw

-1.82

Polar Surface Area

73.360

Acid Dissociation Constant (pKa)

12.59

Base Dissociation Constant (pKb)

-0.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.75

SA87-0588 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SA87-0588 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA87-0588?
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What is the minimum amount of SA87-0588 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA87-0588
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA87-0588
  • 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 SA87-0588 available by request