M461-6180 Screening compound: 3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-N-cyclopentyl-1-methyl-1H-pyrazole-4-carboxamide

M461-6180 Screening compound: 3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-N-cyclopentyl-1-methyl-1H-pyrazole-4-carboxamide
M461-6180 Screening compound: 3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-N-cyclopentyl-1-methyl-1H-pyrazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M461-6180
3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-N-cyclopentyl-1-methyl-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

M461-6180

Molecular Formula

C20H26ClN5O3S (C20 H26 ClN5 O3 S)

Compound Name

3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-N-cyclopentyl-1-methyl-1H-pyrazole-4-carboxamide

IUPAC name

3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-N-cyclopentyl-1-methyl-1H-pyrazole-4-carboxamide

SMILES

Cn(cc1C(NC2CCCC2)=O)nc1S(N(CC1)CCN1c1cccc(Cl)c1)(=O)=O

InChI

InChI=1S/C20H26ClN5O3S/c1-24-14-18(19(27)22-16-6-2-3-7-16)20(23-24)30(28,29)26-11-9-25(10-12-26)17-8-4-5-15(21)13-17/h4-5,8,13-14,16H,2-3,6-7,9-12H2,1H3,(H,22,27)

InChI Key

DSSHMDXBIPDTBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27543211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.797

Distribution Coefficient, logD

2.797

Water Solubility, LogSw

-3.73

Polar Surface Area

74.845

Acid Dissociation Constant (pKa)

13.85

Base Dissociation Constant (pKb)

4.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with M461-6180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M461-6180?
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What is the minimum amount of M461-6180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M461-6180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M461-6180
  • 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 M461-6180 available by request