P087-2296 Screening compound: 1-cyclopropanecarbonyl-N-{[4-(morpholin-4-yl)phenyl]methyl}-2,3-dihydro-1H-indole-4-carboxamide

P087-2296 Screening compound: 1-cyclopropanecarbonyl-N-{[4-(morpholin-4-yl)phenyl]methyl}-2,3-dihydro-1H-indole-4-carboxamide
P087-2296 Screening compound: 1-cyclopropanecarbonyl-N-{[4-(morpholin-4-yl)phenyl]methyl}-2,3-dihydro-1H-indole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P087-2296
1-cyclopropanecarbonyl-N-{[4-(morpholin-4-yl)phenyl]methyl}-2,3-dihydro-1H-indole-4-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

P087-2296

Molecular Formula

C24H27N3O3 (C24 H27 N3 O3)

Compound Name

1-cyclopropanecarbonyl-N-{[4-(morpholin-4-yl)phenyl]methyl}-2,3-dihydro-1H-indole-4-carboxamide

IUPAC name

1-cyclopropanecarbonyl-N-{[4-(morpholin-4-yl)phenyl]methyl}-23-dihydro-1H-indole-4-carboxamide

SMILES

O=C(C1CC1)N1c2cccc(C(NCc(cc3)ccc3N3CCOCC3)=O)c2CC1

InChI

InChI=1S/C24H27N3O3/c28-23(25-16-17-4-8-19(9-5-17)26-12-14-30-15-13-26)21-2-1-3-22-20(21)10-11-27(22)24(29)18-6-7-18/h1-5,8-9,18H,6-7,10-16H2,(H,25,28)

InChI Key

OVTGFEQSALVNOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27563486

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.991

Distribution Coefficient, logD

2.991

Water Solubility, LogSw

-3.61

Polar Surface Area

52.215

Acid Dissociation Constant (pKa)

12.72

Base Dissociation Constant (pKb)

4.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

P087-2296 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

PI3K-Targeted Library (17255 compounds)

SmartTM Library (51161 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Kinases
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P087-2296 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P087-2296?
Check Price and Availability of P087-2296, 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 P087-2296 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P087-2296
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P087-2296
  • 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 P087-2296 available by request