L796-0079 Screening compound: 1-[5-(benzenesulfonyl)thiophene-2-carbonyl]-4-(3-chlorophenyl)piperazine

L796-0079 Screening compound: 1-[5-(benzenesulfonyl)thiophene-2-carbonyl]-4-(3-chlorophenyl)piperazine
L796-0079 Screening compound: 1-[5-(benzenesulfonyl)thiophene-2-carbonyl]-4-(3-chlorophenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound L796-0079
1-[5-(benzenesulfonyl)thiophene-2-carbonyl]-4-(3-chlorophenyl)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

L796-0079

Molecular Formula

C21H19ClN2O3S2 (C21 H19 ClN2 O3 S2)

Compound Name

1-[5-(benzenesulfonyl)thiophene-2-carbonyl]-4-(3-chlorophenyl)piperazine

IUPAC name

1-[5-(benzenesulfonyl)thiophene-2-carbonyl]-4-(3-chlorophenyl)piperazine

SMILES

O=C(c(s1)ccc1S(c1ccccc1)(=O)=O)N(CC1)CCN1c1cccc(Cl)c1

InChI

InChI=1S/C21H19ClN2O3S2/c22-16-5-4-6-17(15-16)23-11-13-24(14-12-23)21(25)19-9-10-20(28-19)29(26,27)18-7-2-1-3-8-18/h1-10,15H,11-14H2

InChI Key

XSRLPMZWCANTRW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27475273

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.98

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.387

Distribution Coefficient, logD

4.387

Water Solubility, LogSw

-4.49

Polar Surface Area

50.666

Acid Dissociation Constant (pKa)

28.24

Base Dissociation Constant (pKb)

1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

L796-0079 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L796-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L796-0079?
Check Price and Availability of L796-0079, 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 L796-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L796-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L796-0079
  • 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 L796-0079 available by request