C336-0023 Screening compound: N~1~-(3-METHOXYPHENYL)-2-[(2-OXO-3-PHENYL-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]ACETAMIDE

C336-0023 Screening compound: N~1~-(3-METHOXYPHENYL)-2-[(2-OXO-3-PHENYL-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]ACETAMIDE
C336-0023 Screening compound: N~1~-(3-METHOXYPHENYL)-2-[(2-OXO-3-PHENYL-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C336-0023
N~1~-(3-METHOXYPHENYL)-2-[(2-OXO-3-PHENYL-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]ACETAMIDE

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

C336-0023

Molecular Formula

C25H20N4O3S (C25 H20 N4 O3 S)

Compound Name

N~1~-(3-METHOXYPHENYL)-2-[(2-OXO-3-PHENYL-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL)SULFANYL]ACETAMIDE

IUPAC name

n/a

SMILES

COc1cccc(NC(CSC(N2C3c4ccccc4)=Nc(cccc4)c4C2=NC3=O)=O)c1

InChI

InChI=1S/C25H20N4O3S/c1-32-18-11-7-10-17(14-18)26-21(30)15-33-25-27-20-13-6-5-12-19(20)23-28-24(31)22(29(23)25)16-8-3-2-4-9-16/h2-14,22H,15H2,1H3,(H,26,30)/t22-/m1/s1

InChI Key

LKRNNYIMHJXYCD-JOCHJYFZSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.784

Distribution Coefficient, logD

3.781

Water Solubility, LogSw

-4.12

Polar Surface Area

65.892

Acid Dissociation Constant (pKa)

9.60

Base Dissociation Constant (pKb)

4.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.00

C336-0023 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C336-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C336-0023?
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What is the minimum amount of C336-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C336-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C336-0023
  • 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 C336-0023 available by request