D483-1549 Screening compound: 2-{[5-({2,9-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide

D483-1549 Screening compound: 2-{[5-({2,9-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
D483-1549 Screening compound: 2-{[5-({2,9-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D483-1549
2-{[5-({2,9-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)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

D483-1549

Molecular Formula

C23H24N6O2S (C23 H24 N6 O2 S)

Compound Name

2-{[5-({2,9-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide

IUPAC name

2-{[5-({29-dimethyl-4-oxo-4H-pyrido[12-a]pyrimidin-3-yl}methyl)-4-methyl-4H-124-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide

SMILES

Cc(cc1)ccc1NC(CSc1nnc(CC2=C(C)N=C(C(C)=CC=C3)N3C2=O)n1C)=O

InChI

InChI=1S/C23H24N6O2S/c1-14-7-9-17(10-8-14)25-20(30)13-32-23-27-26-19(28(23)4)12-18-16(3)24-21-15(2)6-5-11-29(21)22(18)31/h5-11H,12-13H2,1-4H3,(H,25,30)

InChI Key

JAMNGEPAWBATGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14831995

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.261

Distribution Coefficient, logD

2.261

Water Solubility, LogSw

-2.72

Polar Surface Area

73.095

Acid Dissociation Constant (pKa)

12.68

Base Dissociation Constant (pKb)

2.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

D483-1549 in Drug Discovery

Included in Screening Libraries

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D483-1549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D483-1549?
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What is the minimum amount of D483-1549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D483-1549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D483-1549
  • 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 D483-1549 available by request