L881-0444 Screening compound: 4-chloro-N-{2-[4-(3-methylphenyl)piperazine-1-carbonyl]-1H-indol-3-yl}benzamide

L881-0444 Screening compound: 4-chloro-N-{2-[4-(3-methylphenyl)piperazine-1-carbonyl]-1H-indol-3-yl}benzamide
L881-0444 Screening compound: 4-chloro-N-{2-[4-(3-methylphenyl)piperazine-1-carbonyl]-1H-indol-3-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L881-0444
4-chloro-N-{2-[4-(3-methylphenyl)piperazine-1-carbonyl]-1H-indol-3-yl}benzamide

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

L881-0444

Molecular Formula

C27H25ClN4O2 (C27 H25 ClN4 O2)

Compound Name

4-chloro-N-{2-[4-(3-methylphenyl)piperazine-1-carbonyl]-1H-indol-3-yl}benzamide

IUPAC name

4-chloro-N-{2-[4-(3-methylphenyl)piperazine-1-carbonyl]-1H-indol-3-yl}benzamide

SMILES

Cc1cccc(N(CC2)CCN2C(c([nH]c2c3cccc2)c3NC(c(cc2)ccc2Cl)=O)=O)c1

InChI

InChI=1S/C27H25ClN4O2/c1-18-5-4-6-21(17-18)31-13-15-32(16-14-31)27(34)25-24(22-7-2-3-8-23(22)29-25)30-26(33)19-9-11-20(28)12-10-19/h2-12,17,29H,13-16H2,1H3,(H,30,33)

InChI Key

DXANZKCJTWDSJQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15136192

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.97

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.495

Distribution Coefficient, logD

3.967

Water Solubility, LogSw

-4.71

Polar Surface Area

51.962

Acid Dissociation Constant (pKa)

7.02

Base Dissociation Constant (pKb)

6.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

L881-0444 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L881-0444 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L881-0444?
Check Price and Availability of L881-0444, 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 L881-0444 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L881-0444
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L881-0444
  • 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 L881-0444 available by request