D483-1837 Screening compound: 8-chloro-2-({[4-methyl-5-({2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,4-dihydroquinolin-4-one

D483-1837 Screening compound: 8-chloro-2-({[4-methyl-5-({2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,4-dihydroquinolin-4-one
D483-1837 Screening compound: 8-chloro-2-({[4-methyl-5-({2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,4-dihydroquinolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D483-1837
8-chloro-2-({[4-methyl-5-({2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,4-dihydroquinolin-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

D483-1837

Molecular Formula

C23H19ClN6O2S (C23 H19 ClN6 O2 S)

Compound Name

8-chloro-2-({[4-methyl-5-({2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,4-dihydroquinolin-4-one

IUPAC name

8-chloro-2-({[4-methyl-5-({2-methyl-4-oxo-4H-pyrido[12-a]pyrimidin-3-yl}methyl)-4H-124-triazol-3-yl]sulfanyl}methyl)-14-dihydroquinolin-4-one

SMILES

CC(N=C1N2C=CC=C1)=C(Cc(n1C)nnc1SCC(Nc(c1ccc3)c3Cl)=CC1=O)C2=O

InChI

InChI=1S/C23H19ClN6O2S/c1-13-16(22(32)30-9-4-3-8-19(30)25-13)11-20-27-28-23(29(20)2)33-12-14-10-18(31)15-6-5-7-17(24)21(15)26-14/h3-10H,11-12H2,1-2H3,(H,26,31)

InChI Key

YXPHGTMCMOUMKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14832052

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.96

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.449

Distribution Coefficient, logD

2.189

Water Solubility, LogSw

-3.51

Polar Surface Area

73.467

Acid Dissociation Constant (pKa)

7.48

Base Dissociation Constant (pKb)

2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

D483-1837 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D483-1837 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D483-1837?
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What is the minimum amount of D483-1837 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D483-1837
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D483-1837
  • 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 D483-1837 available by request