K786-0748 Screening compound: N-CYCLOPENTYL-4-(2,3-DIHYDRO-1H-INDOL-1-YL)-3-(1H-IMIDAZOL-1-YL)-4-OXOBUTANAMIDE

K786-0748 Screening compound: N-CYCLOPENTYL-4-(2,3-DIHYDRO-1H-INDOL-1-YL)-3-(1H-IMIDAZOL-1-YL)-4-OXOBUTANAMIDE
K786-0748 Screening compound: N-CYCLOPENTYL-4-(2,3-DIHYDRO-1H-INDOL-1-YL)-3-(1H-IMIDAZOL-1-YL)-4-OXOBUTANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-0748
N-CYCLOPENTYL-4-(2,3-DIHYDRO-1H-INDOL-1-YL)-3-(1H-IMIDAZOL-1-YL)-4-OXOBUTANAMIDE

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

K786-0748

Molecular Formula

C20H24N4O2 (C20 H24 N4 O2)

Compound Name

N-CYCLOPENTYL-4-(2,3-DIHYDRO-1H-INDOL-1-YL)-3-(1H-IMIDAZOL-1-YL)-4-OXOBUTANAMIDE

IUPAC name

N-cyclopentyl-4-(23-dihydro-1H-indol-1-yl)-3-(1H-imidazol-1-yl)-4-oxobutanamide

SMILES

O=C(CC(C(N(CC1)c2c1cccc2)=O)n1cncc1)NC1CCCC1

InChI

InChI=1S/C20H24N4O2/c25-19(22-16-6-2-3-7-16)13-18(23-12-10-21-14-23)20(26)24-11-9-15-5-1-4-8-17(15)24/h1,4-5,8,10,12,14,16,18H,2-3,6-7,9,11,13H2,(H,22,25)/t18-/m0/s1

InChI Key

DVWMRCJAHKORRI-SFHVURJKSA-N

MDL Number (MFCD)

MFCD03830942

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.44

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

1.802

Distribution Coefficient, logD

1.796

Water Solubility, LogSw

-2.00

Polar Surface Area

52.742

Acid Dissociation Constant (pKa)

15.23

Base Dissociation Constant (pKb)

5.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.00

K786-0748 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with K786-0748 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-0748?
Check Price and Availability of K786-0748, 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 K786-0748 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-0748
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-0748
  • 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 K786-0748 available by request