L540-0946 Screening compound: ethyl 2-({5-[(4-chlorophenyl)sulfamoyl]-3-methyl-1H-pyrazol-4-yl}formamido)acetate

L540-0946 Screening compound: ethyl 2-({5-[(4-chlorophenyl)sulfamoyl]-3-methyl-1H-pyrazol-4-yl}formamido)acetate
L540-0946 Screening compound: ethyl 2-({5-[(4-chlorophenyl)sulfamoyl]-3-methyl-1H-pyrazol-4-yl}formamido)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound L540-0946
ethyl 2-({5-[(4-chlorophenyl)sulfamoyl]-3-methyl-1H-pyrazol-4-yl}formamido)acetate

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

L540-0946

Molecular Formula

C15H17ClN4O5S (C15 H17 ClN4 O5 S)

Compound Name

ethyl 2-({5-[(4-chlorophenyl)sulfamoyl]-3-methyl-1H-pyrazol-4-yl}formamido)acetate

IUPAC name

ethyl 2-({5-[(4-chlorophenyl)sulfamoyl]-3-methyl-1H-pyrazol-4-yl}formamido)acetate

SMILES

CCOC(CNC(c(c(C)n[nH]1)c1S(Nc(cc1)ccc1Cl)(=O)=O)=O)=O

InChI

InChI=1S/C15H17ClN4O5S/c1-3-25-12(21)8-17-14(22)13-9(2)18-19-15(13)26(23,24)20-11-6-4-10(16)5-7-11/h4-7,20H,3,8H2,1-2H3,(H,17,22)(H,18,19)

InChI Key

DXTDCCDLQRQIEC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27460715

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.84

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.873

Distribution Coefficient, logD

1.752

Water Solubility, LogSw

-3.21

Polar Surface Area

109.615

Acid Dissociation Constant (pKa)

7.89

Base Dissociation Constant (pKb)

-3.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

L540-0946 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with L540-0946 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L540-0946?
Check Price and Availability of L540-0946, 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 L540-0946 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L540-0946
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L540-0946
  • 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 L540-0946 available by request