M461-8139 Screening compound: 3-(1-AZEPANYLSULFONYL)-1-ETHYL-N-(4-METHYLPHENYL)-1H-PYRAZOLE-4-CARBOXAMIDE

M461-8139 Screening compound: 3-(1-AZEPANYLSULFONYL)-1-ETHYL-N-(4-METHYLPHENYL)-1H-PYRAZOLE-4-CARBOXAMIDE
M461-8139 Screening compound: 3-(1-AZEPANYLSULFONYL)-1-ETHYL-N-(4-METHYLPHENYL)-1H-PYRAZOLE-4-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound M461-8139
3-(1-AZEPANYLSULFONYL)-1-ETHYL-N-(4-METHYLPHENYL)-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

M461-8139

Molecular Formula

C19H26N4O3S (C19 H26 N4 O3 S)

Compound Name

3-(1-AZEPANYLSULFONYL)-1-ETHYL-N-(4-METHYLPHENYL)-1H-PYRAZOLE-4-CARBOXAMIDE

IUPAC name

n/a

SMILES

CCn(cc1C(Nc2ccc(C)cc2)=O)nc1S(N1CCCCCC1)(=O)=O

InChI

InChI=1S/C19H26N4O3S/c1-3-22-14-17(18(24)20-16-10-8-15(2)9-11-16)19(21-22)27(25,26)23-12-6-4-5-7-13-23/h8-11,14H,3-7,12-13H2,1-2H3,(H,20,24)

InChI Key

CMTLAGMRRKSGMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27543463

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.974

Distribution Coefficient, logD

2.974

Water Solubility, LogSw

-3.48

Polar Surface Area

70.195

Acid Dissociation Constant (pKa)

10.11

Base Dissociation Constant (pKb)

-1.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with M461-8139 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M461-8139?
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What is the minimum amount of M461-8139 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M461-8139
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M461-8139
  • 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 M461-8139 available by request