G568-0045 Screening compound: N~1~-(2,5-DIMETHYLPHENYL)-2-[(3-ISOPROPYL-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]BUTANAMIDE

G568-0045 Screening compound: N~1~-(2,5-DIMETHYLPHENYL)-2-[(3-ISOPROPYL-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]BUTANAMIDE
G568-0045 Screening compound: N~1~-(2,5-DIMETHYLPHENYL)-2-[(3-ISOPROPYL-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]BUTANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound G568-0045
N~1~-(2,5-DIMETHYLPHENYL)-2-[(3-ISOPROPYL-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

G568-0045

Molecular Formula

C25H28N4O2S (C25 H28 N4 O2 S)

Compound Name

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

IUPAC name

n/a

SMILES

CCC(C(Nc1c(C)ccc(C)c1)=O)SC(N1C2C(C)C)=Nc(cccc3)c3C1=NC2=O

InChI

InChI=1S/C25H28N4O2S/c1-6-20(23(30)26-19-13-15(4)11-12-16(19)5)32-25-27-18-10-8-7-9-17(18)22-28-24(31)21(14(2)3)29(22)25/h7-14,20-21H,6H2,1-5H3,(H,26,30)

InChI Key

YFBCTIPDJUUSNK-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.516

Distribution Coefficient, logD

4.515

Water Solubility, LogSw

-4.30

Polar Surface Area

58.136

Acid Dissociation Constant (pKa)

11.84

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

36.00

G568-0045 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with G568-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G568-0045?
Check Price and Availability of G568-0045, 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 G568-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G568-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G568-0045
  • 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 G568-0045 available by request