D488-0431 Screening compound: 4-chloro-N-{2-methyl-3-[(morpholin-4-yl)(pyridin-2-yl)methyl]-1H-indol-5-yl}benzamide

D488-0431 Screening compound: 4-chloro-N-{2-methyl-3-[(morpholin-4-yl)(pyridin-2-yl)methyl]-1H-indol-5-yl}benzamide
D488-0431 Screening compound: 4-chloro-N-{2-methyl-3-[(morpholin-4-yl)(pyridin-2-yl)methyl]-1H-indol-5-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D488-0431
4-chloro-N-{2-methyl-3-[(morpholin-4-yl)(pyridin-2-yl)methyl]-1H-indol-5-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

D488-0431

Molecular Formula

C26H25ClN4O2 (C26 H25 ClN4 O2)

Compound Name

4-chloro-N-{2-methyl-3-[(morpholin-4-yl)(pyridin-2-yl)methyl]-1H-indol-5-yl}benzamide

IUPAC name

4-chloro-N-{2-methyl-3-[(morpholin-4-yl)(pyridin-2-yl)methyl]-1H-indol-5-yl}benzamide

SMILES

Cc1c(C(c2ncccc2)N2CCOCC2)c(cc(cc2)NC(c(cc3)ccc3Cl)=O)c2[nH]1

InChI

InChI=1S/C26H25ClN4O2/c1-17-24(25(23-4-2-3-11-28-23)31-12-14-33-15-13-31)21-16-20(9-10-22(21)29-17)30-26(32)18-5-7-19(27)8-6-18/h2-11,16,25,29H,12-15H2,1H3,(H,30,32)/t25-/m1/s1

InChI Key

DAMQZPVGROFRBS-RUZDIDTESA-N

MDL Number (MFCD)

MFCD27589177

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.96

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.210

Distribution Coefficient, logD

4.192

Water Solubility, LogSw

-4.55

Polar Surface Area

52.965

Acid Dissociation Constant (pKa)

9.86

Base Dissociation Constant (pKb)

5.99

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

D488-0431 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Lipid Metabolism Library (9174 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D488-0431 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D488-0431?
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What is the minimum amount of D488-0431 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D488-0431
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D488-0431
  • 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 D488-0431 available by request