L586-0055 Screening compound: 1-[2-chloro-5-(pyrrolidine-1-sulfonyl)benzoyl]-4-(2,3-dimethylphenyl)piperazine

L586-0055 Screening compound: 1-[2-chloro-5-(pyrrolidine-1-sulfonyl)benzoyl]-4-(2,3-dimethylphenyl)piperazine
L586-0055 Screening compound: 1-[2-chloro-5-(pyrrolidine-1-sulfonyl)benzoyl]-4-(2,3-dimethylphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound L586-0055
1-[2-chloro-5-(pyrrolidine-1-sulfonyl)benzoyl]-4-(2,3-dimethylphenyl)piperazine

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

L586-0055

Molecular Formula

C23H28ClN3O3S (C23 H28 ClN3 O3 S)

Compound Name

1-[2-chloro-5-(pyrrolidine-1-sulfonyl)benzoyl]-4-(2,3-dimethylphenyl)piperazine

IUPAC name

1-[2-chloro-5-(pyrrolidine-1-sulfonyl)benzoyl]-4-(23-dimethylphenyl)piperazine

SMILES

Cc1cccc(N(CC2)CCN2C(c(cc(cc2)S(N3CCCC3)(=O)=O)c2Cl)=O)c1C

InChI

InChI=1S/C23H28ClN3O3S/c1-17-6-5-7-22(18(17)2)25-12-14-26(15-13-25)23(28)20-16-19(8-9-21(20)24)31(29,30)27-10-3-4-11-27/h5-9,16H,3-4,10-15H2,1-2H3

InChI Key

KOLFDQDDWWDJRB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13904620

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.01

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.527

Distribution Coefficient, logD

4.527

Water Solubility, LogSw

-4.67

Polar Surface Area

51.923

Acid Dissociation Constant (pKa)

27.94

Base Dissociation Constant (pKb)

4.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

L586-0055 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L586-0055 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L586-0055?
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What is the minimum amount of L586-0055 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L586-0055
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L586-0055
  • 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 L586-0055 available by request