L276-0229 Screening compound: 2-{[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]methyl}-1-methyl-N-(propan-2-yl)-1H-1,3-benzodiazole-5-carboxamide

L276-0229 Screening compound: 2-{[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]methyl}-1-methyl-N-(propan-2-yl)-1H-1,3-benzodiazole-5-carboxamide
L276-0229 Screening compound: 2-{[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]methyl}-1-methyl-N-(propan-2-yl)-1H-1,3-benzodiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L276-0229
2-{[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]methyl}-1-methyl-N-(propan-2-yl)-1H-1,3-benzodiazole-5-carboxamide

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

L276-0229

Molecular Formula

C25H33N5O3S (C25 H33 N5 O3 S)

Compound Name

2-{[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]methyl}-1-methyl-N-(propan-2-yl)-1H-1,3-benzodiazole-5-carboxamide

IUPAC name

2-{[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]methyl}-1-methyl-N-(propan-2-yl)-1H-13-benzodiazole-5-carboxamide

SMILES

CCc(cc1)ccc1S(N1CCN(Cc2nc(cc(cc3)C(NC(C)C)=O)c3n2C)CC1)(=O)=O

InChI

InChI=1S/C25H33N5O3S/c1-5-19-6-9-21(10-7-19)34(32,33)30-14-12-29(13-15-30)17-24-27-22-16-20(25(31)26-18(2)3)8-11-23(22)28(24)4/h6-11,16,18H,5,12-15,17H2,1-4H3,(H,26,31)

InChI Key

LCDHOVHSHVJDKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27239110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.016

Distribution Coefficient, logD

2.970

Water Solubility, LogSw

-3.54

Polar Surface Area

71.135

Acid Dissociation Constant (pKa)

14.08

Base Dissociation Constant (pKb)

6.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

L276-0229 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with L276-0229 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L276-0229?
Check Price and Availability of L276-0229, 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 L276-0229 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L276-0229
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L276-0229
  • 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 L276-0229 available by request