L126-0061 Screening compound: N-[(2-chlorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide

L126-0061 Screening compound: N-[(2-chlorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide
L126-0061 Screening compound: N-[(2-chlorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L126-0061
N-[(2-chlorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-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

L126-0061

Molecular Formula

C18H22ClN3O3S2 (C18 H22 ClN3 O3 S2)

Compound Name

N-[(2-chlorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide

IUPAC name

N-[(2-chlorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide

SMILES

O=C(c1cccs1)N(CCS(N1CCNCC1)(=O)=O)Cc(cccc1)c1Cl

InChI

InChI=1S/C18H22ClN3O3S2/c19-16-5-2-1-4-15(16)14-21(18(23)17-6-3-12-26-17)11-13-27(24,25)22-9-7-20-8-10-22/h1-6,12,20H,7-11,13-14H2

InChI Key

BYRWMQZMIQVNBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27234045

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

427.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.063

Distribution Coefficient, logD

1.719

Water Solubility, LogSw

-2.79

Polar Surface Area

61.012

Acid Dissociation Constant (pKa)

22.05

Base Dissociation Constant (pKb)

7.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

L126-0061 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L126-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L126-0061?
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What is the minimum amount of L126-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L126-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L126-0061
  • 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 L126-0061 available by request