M461-1628 Screening compound: N-(4-methoxyphenyl)-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide

M461-1628 Screening compound: N-(4-methoxyphenyl)-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
M461-1628 Screening compound: N-(4-methoxyphenyl)-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M461-1628
N-(4-methoxyphenyl)-1-methyl-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

M461-1628

Molecular Formula

C16H20N4O4S2 (C16 H20 N4 O4 S2)

Compound Name

N-(4-methoxyphenyl)-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide

IUPAC name

N-(4-methoxyphenyl)-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide

SMILES

Cn(cc1C(Nc(cc2)ccc2OC)=O)nc1S(N1CCSCC1)(=O)=O

InChI

InChI=1S/C16H20N4O4S2/c1-19-11-14(15(21)17-12-3-5-13(24-2)6-4-12)16(18-19)26(22,23)20-7-9-25-10-8-20/h3-6,11H,7-10H2,1-2H3,(H,17,21)

InChI Key

LOZAZNGMQSAADE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27543090

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.219

Distribution Coefficient, logD

1.217

Water Solubility, LogSw

-2.35

Polar Surface Area

77.715

Acid Dissociation Constant (pKa)

9.90

Base Dissociation Constant (pKb)

-2.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

M461-1628 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with M461-1628 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M461-1628?
Check Price and Availability of M461-1628, 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 M461-1628 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M461-1628
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M461-1628
  • 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 M461-1628 available by request