L413-0282 Screening compound: 2-METHYL-1-[5-(4-{[4-(2-PYRIDYL)PIPERAZINO]CARBONYL}PHENYL)-2,3-DIHYDRO-1H-INDOL-1-YL]-1-PROPANONE

L413-0282 Screening compound: 2-METHYL-1-[5-(4-{[4-(2-PYRIDYL)PIPERAZINO]CARBONYL}PHENYL)-2,3-DIHYDRO-1H-INDOL-1-YL]-1-PROPANONE
L413-0282 Screening compound: 2-METHYL-1-[5-(4-{[4-(2-PYRIDYL)PIPERAZINO]CARBONYL}PHENYL)-2,3-DIHYDRO-1H-INDOL-1-YL]-1-PROPANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound L413-0282
2-METHYL-1-[5-(4-{[4-(2-PYRIDYL)PIPERAZINO]CARBONYL}PHENYL)-2,3-DIHYDRO-1H-INDOL-1-YL]-1-PROPANONE

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

L413-0282

Molecular Formula

C28H30N4O2 (C28 H30 N4 O2)

Compound Name

2-METHYL-1-[5-(4-{[4-(2-PYRIDYL)PIPERAZINO]CARBONYL}PHENYL)-2,3-DIHYDRO-1H-INDOL-1-YL]-1-PROPANONE

IUPAC name

2-methyl-1-(5-{4-[4-(pyridin-2-yl)piperazine-1-carbonyl]phenyl}-23-dihydro-1H-indol-1-yl)propan-1-one

SMILES

CC(C)C(N(CC1)c(cc2)c1cc2-c(cc1)ccc1C(N(CC1)CCN1c1ncccc1)=O)=O

InChI

InChI=1S/C28H30N4O2/c1-20(2)27(33)32-14-12-24-19-23(10-11-25(24)32)21-6-8-22(9-7-21)28(34)31-17-15-30(16-18-31)26-5-3-4-13-29-26/h3-11,13,19-20H,12,14-18H2,1-2H3

InChI Key

BJYNMBYRUTTYKQ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.678

Distribution Coefficient, logD

4.669

Water Solubility, LogSw

-4.40

Polar Surface Area

44.337

Acid Dissociation Constant (pKa)

21.07

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.14

L413-0282 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Bromodomain Modulators Library (5801 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L413-0282 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L413-0282?
Check Price and Availability of L413-0282, 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 L413-0282 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L413-0282
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L413-0282
  • 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 L413-0282 available by request