SA93-0257 Screening compound: 1-[3-(3-chlorophenyl)-1H-pyrazole-5-carbonyl]-3-ethylpiperidine-3-carboxamide

SA93-0257 Screening compound: 1-[3-(3-chlorophenyl)-1H-pyrazole-5-carbonyl]-3-ethylpiperidine-3-carboxamide
SA93-0257 Screening compound: 1-[3-(3-chlorophenyl)-1H-pyrazole-5-carbonyl]-3-ethylpiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA93-0257
1-[3-(3-chlorophenyl)-1H-pyrazole-5-carbonyl]-3-ethylpiperidine-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

SA93-0257

Molecular Formula

C18H21ClN4O2 (C18 H21 ClN4 O2)

Compound Name

1-[3-(3-chlorophenyl)-1H-pyrazole-5-carbonyl]-3-ethylpiperidine-3-carboxamide

IUPAC name

1-[3-(3-chlorophenyl)-1H-pyrazole-5-carbonyl]-3-ethylpiperidine-3-carboxamide

SMILES

CCC(CCC1)(CN1C(c1cc(-c2cccc(Cl)c2)n[nH]1)=O)C(N)=O

InChI

InChI=1S/C18H21ClN4O2/c1-2-18(17(20)25)7-4-8-23(11-18)16(24)15-10-14(21-22-15)12-5-3-6-13(19)9-12/h3,5-6,9-10H,2,4,7-8,11H2,1H3,(H2,20,25)(H,21,22)/t18-/m0/s1

InChI Key

IXJKPUDNPGQQRY-SFHVURJKSA-N

MDL Number (MFCD)

MFCD32243108

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.84

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.697

Distribution Coefficient, logD

2.696

Water Solubility, LogSw

-3.53

Polar Surface Area

73.369

Acid Dissociation Constant (pKa)

6.91

Base Dissociation Constant (pKb)

0.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.89

SA93-0257 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with SA93-0257 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA93-0257?
Check Price and Availability of SA93-0257, 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 SA93-0257 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA93-0257
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA93-0257
  • 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 SA93-0257 available by request