M461-1719 Screening compound: 1-ethyl-N-(3-ethylphenyl)-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide

M461-1719 Screening compound: 1-ethyl-N-(3-ethylphenyl)-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
M461-1719 Screening compound: 1-ethyl-N-(3-ethylphenyl)-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M461-1719
1-ethyl-N-(3-ethylphenyl)-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-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

M461-1719

Molecular Formula

C18H24N4O3S2 (C18 H24 N4 O3 S2)

Compound Name

1-ethyl-N-(3-ethylphenyl)-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide

IUPAC name

1-ethyl-N-(3-ethylphenyl)-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide

SMILES

CCc1cccc(NC(c2cn(CC)nc2S(N2CCSCC2)(=O)=O)=O)c1

InChI

InChI=1S/C18H24N4O3S2/c1-3-14-6-5-7-15(12-14)19-17(23)16-13-21(4-2)20-18(16)27(24,25)22-8-10-26-11-9-22/h5-7,12-13H,3-4,8-11H2,1-2H3,(H,19,23)

InChI Key

UXGJWESLEBQGTN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27543106

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.441

Distribution Coefficient, logD

2.441

Water Solubility, LogSw

-3.01

Polar Surface Area

69.864

Acid Dissociation Constant (pKa)

10.43

Base Dissociation Constant (pKb)

-2.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

M461-1719 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 M461-1719 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M461-1719?
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What is the minimum amount of M461-1719 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M461-1719
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M461-1719
  • 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 M461-1719 available by request