C779-1793 Screening compound: [4-(4-chlorobenzyl)-4H-thieno[3,2-b]pyrrol-5-yl][4-(piperidinocarbonyl)piperidino]methanone

C779-1793 Screening compound: [4-(4-chlorobenzyl)-4H-thieno[3,2-b]pyrrol-5-yl][4-(piperidinocarbonyl)piperidino]methanone
C779-1793 Screening compound: [4-(4-chlorobenzyl)-4H-thieno[3,2-b]pyrrol-5-yl][4-(piperidinocarbonyl)piperidino]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound C779-1793
[4-(4-chlorobenzyl)-4H-thieno[3,2-b]pyrrol-5-yl][4-(piperidinocarbonyl)piperidino]methanone

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

C779-1793

Molecular Formula

C25H28ClN3O2S (C25 H28 ClN3 O2 S)

Compound Name

[4-(4-chlorobenzyl)-4H-thieno[3,2-b]pyrrol-5-yl][4-(piperidinocarbonyl)piperidino]methanone

IUPAC name

1-{4-[(4-chlorophenyl)methyl]-4H-thieno[32-b]pyrrole-5-carbonyl}-4-(piperidine-1-carbonyl)piperidine

SMILES

O=C(C(CC1)CCN1C(c1cc(scc2)c2n1Cc(cc1)ccc1Cl)=O)N1CCCCC1

InChI

InChI=1S/C25H28ClN3O2S/c26-20-6-4-18(5-7-20)17-29-21-10-15-32-23(21)16-22(29)25(31)28-13-8-19(9-14-28)24(30)27-11-2-1-3-12-27/h4-7,10,15-16,19H,1-3,8-9,11-14,17H2

InChI Key

PXOUPXCOEPTHJG-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.04

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.724

Distribution Coefficient, logD

4.724

Water Solubility, LogSw

-4.94

Polar Surface Area

35.007

Acid Dissociation Constant (pKa)

23.62

Base Dissociation Constant (pKb)

0.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

References: we are preparing a list of scientific research reports with C779-1793 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C779-1793?
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What is the minimum amount of C779-1793 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C779-1793
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C779-1793
  • 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 C779-1793 available by request