D163-0983 Screening compound: 3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(1E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-3,4-dihydroquinazolin-4-one

D163-0983 Screening compound: 3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(1E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-3,4-dihydroquinazolin-4-one
D163-0983 Screening compound: 3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(1E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D163-0983
3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(1E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-3,4-dihydroquinazolin-4-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

D163-0983

Molecular Formula

C30H25N5O2 (C30 H25 N5 O2)

Compound Name

3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(1E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-3,4-dihydroquinazolin-4-one

IUPAC name

3-(15-dimethyl-3-oxo-2-phenyl-23-dihydro-1H-pyrazol-4-yl)-2-[(1E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-34-dihydroquinazolin-4-one

SMILES

CC(N(C)N(C1=O)c2ccccc2)=C1N(C(/C=C/c1cn(C)c2c1cccc2)=Nc1c2cccc1)C2=O

InChI

InChI=1S/C30H25N5O2/c1-20-28(30(37)35(33(20)3)22-11-5-4-6-12-22)34-27(31-25-15-9-7-14-24(25)29(34)36)18-17-21-19-32(2)26-16-10-8-13-23(21)26/h4-19H,1-3H3

InChI Key

GNQQBRIHPQUFJQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06166717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.283

Distribution Coefficient, logD

3.283

Water Solubility, LogSw

-3.60

Polar Surface Area

47.254

Acid Dissociation Constant (pKa)

29.44

Base Dissociation Constant (pKb)

1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

D163-0983 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with D163-0983 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D163-0983?
Check Price and Availability of D163-0983, 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 D163-0983 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D163-0983
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D163-0983
  • 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 D163-0983 available by request