C200-0158 Screening compound: 3-BENZYL-1-[(3-CHLOROPHENYL)METHYL]-1,2,3,4-TETRAHYDROQUINAZOLINE-2,4-DIONE

C200-0158 Screening compound: 3-BENZYL-1-[(3-CHLOROPHENYL)METHYL]-1,2,3,4-TETRAHYDROQUINAZOLINE-2,4-DIONE
C200-0158 Screening compound: 3-BENZYL-1-[(3-CHLOROPHENYL)METHYL]-1,2,3,4-TETRAHYDROQUINAZOLINE-2,4-DIONE alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-0158
3-BENZYL-1-[(3-CHLOROPHENYL)METHYL]-1,2,3,4-TETRAHYDROQUINAZOLINE-2,4-DIONE

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

C200-0158

Molecular Formula

C22H17ClN2O2 (C22 H17 ClN2 O2)

Compound Name

3-BENZYL-1-[(3-CHLOROPHENYL)METHYL]-1,2,3,4-TETRAHYDROQUINAZOLINE-2,4-DIONE

IUPAC name

n/a

SMILES

O=C(c(cccc1)c1N1Cc2cccc(Cl)c2)N(Cc2ccccc2)C1=O

InChI

InChI=1S/C22H17ClN2O2/c23-18-10-6-9-17(13-18)15-24-20-12-5-4-11-19(20)21(26)25(22(24)27)14-16-7-2-1-3-8-16/h1-13H,14-15H2

InChI Key

WPSVGVSGESMQCD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14725464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.970

Distribution Coefficient, logD

4.970

Water Solubility, LogSw

-4.98

Polar Surface Area

31.267

Acid Dissociation Constant (pKa)

27.73

Base Dissociation Constant (pKb)

-8.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

C200-0158 in Drug Discovery

Included in Screening Libraries

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

GABA Library (7115 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C200-0158 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-0158?
Check Price and Availability of C200-0158, 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 C200-0158 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-0158
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-0158
  • 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 C200-0158 available by request