L127-0827 Screening compound: 3,4-dimethyl-N-[2-(2-methylpiperidin-1-yl)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide

L127-0827 Screening compound: 3,4-dimethyl-N-[2-(2-methylpiperidin-1-yl)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide
L127-0827 Screening compound: 3,4-dimethyl-N-[2-(2-methylpiperidin-1-yl)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L127-0827
3,4-dimethyl-N-[2-(2-methylpiperidin-1-yl)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide

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

L127-0827

Molecular Formula

C22H38N4O4S2 (C22 H38 N4 O4 S2)

Compound Name

3,4-dimethyl-N-[2-(2-methylpiperidin-1-yl)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide

IUPAC name

34-dimethyl-N-[2-(2-methylpiperidin-1-yl)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide

SMILES

CC1N(CCN(CCS(N2CCNCC2)(=O)=O)S(c2cc(C)c(C)cc2)(=O)=O)CCCC1

InChI

InChI=1S/C22H38N4O4S2/c1-19-7-8-22(18-20(19)2)32(29,30)26(15-14-24-11-5-4-6-21(24)3)16-17-31(27,28)25-12-9-23-10-13-25/h7-8,18,21,23H,4-6,9-17H2,1-3H3/t21-/m0/s1

InChI Key

KWBWWYKDLGYEAW-NRFANRHFSA-N

MDL Number (MFCD)

MFCD15119133

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

486.7

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.980

Distribution Coefficient, logD

1.579

Water Solubility, LogSw

-2.59

Polar Surface Area

78.570

Acid Dissociation Constant (pKa)

22.14

Base Dissociation Constant (pKb)

7.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

72.70

L127-0827 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with L127-0827 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L127-0827?
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What is the minimum amount of L127-0827 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L127-0827
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L127-0827
  • 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 L127-0827 available by request