G568-0012 Screening compound: N~1~-(2-FLUOROPHENYL)-2-[(3-METHYL-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]BUTANAMIDE

G568-0012 Screening compound: N~1~-(2-FLUOROPHENYL)-2-[(3-METHYL-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]BUTANAMIDE
G568-0012 Screening compound: N~1~-(2-FLUOROPHENYL)-2-[(3-METHYL-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]BUTANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound G568-0012
N~1~-(2-FLUOROPHENYL)-2-[(3-METHYL-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]BUTANAMIDE

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

G568-0012

Molecular Formula

C21H19FN4O2S (C21 H19 FN4 O2 S)

Compound Name

N~1~-(2-FLUOROPHENYL)-2-[(3-METHYL-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]BUTANAMIDE

IUPAC name

n/a

SMILES

CCC(C(Nc(cccc1)c1F)=O)SC(N1C2C)=Nc(cccc3)c3C1=NC2=O

InChI

InChI=1S/C21H19FN4O2S/c1-3-17(20(28)23-16-11-7-5-9-14(16)22)29-21-24-15-10-6-4-8-13(15)18-25-19(27)12(2)26(18)21/h4-12,17H,3H2,1-2H3,(H,23,28)

InChI Key

RXVULBMBWDCXRA-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.292

Distribution Coefficient, logD

3.283

Water Solubility, LogSw

-3.84

Polar Surface Area

57.727

Acid Dissociation Constant (pKa)

10.69

Base Dissociation Constant (pKb)

5.72

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

23.80

G568-0012 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G568-0012 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G568-0012?
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What is the minimum amount of G568-0012 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G568-0012
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G568-0012
  • 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 G568-0012 available by request