8341-0137 Screening compound: 2-(2,3-dihydro-1H-indol-1-yl)-7-phenyl-5,6,7,8-tetrahydroquinazolin-5-one

8341-0137 Screening compound: 2-(2,3-dihydro-1H-indol-1-yl)-7-phenyl-5,6,7,8-tetrahydroquinazolin-5-one
8341-0137 Screening compound: 2-(2,3-dihydro-1H-indol-1-yl)-7-phenyl-5,6,7,8-tetrahydroquinazolin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8341-0137
2-(2,3-dihydro-1H-indol-1-yl)-7-phenyl-5,6,7,8-tetrahydroquinazolin-5-one

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

8341-0137

Molecular Formula

C22H19N3O (C22 H19 N3 O)

Compound Name

2-(2,3-dihydro-1H-indol-1-yl)-7-phenyl-5,6,7,8-tetrahydroquinazolin-5-one

IUPAC name

2-(23-dihydro-1H-indol-1-yl)-7-phenyl-5678-tetrahydroquinazolin-5-one

SMILES

O=C(CC(C1)c2ccccc2)c2c1nc(N(CC1)c3c1cccc3)nc2

InChI

InChI=1S/C22H19N3O/c26-21-13-17(15-6-2-1-3-7-15)12-19-18(21)14-23-22(24-19)25-11-10-16-8-4-5-9-20(16)25/h1-9,14,17H,10-13H2/t17-/m1/s1

InChI Key

XWKHRPYKFJBBTB-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD04174970

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.436

Distribution Coefficient, logD

4.436

Water Solubility, LogSw

-4.38

Polar Surface Area

35.139

Acid Dissociation Constant (pKa)

16.67

Base Dissociation Constant (pKb)

2.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

8341-0137 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human GPCR Annotated Library (5539 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 8341-0137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8341-0137?
Check Price and Availability of 8341-0137, 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 8341-0137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8341-0137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8341-0137
  • 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 8341-0137 available by request