D483-1220 Screening compound: 2-{[5-({2,7-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide

D483-1220 Screening compound: 2-{[5-({2,7-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide
D483-1220 Screening compound: 2-{[5-({2,7-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D483-1220
2-{[5-({2,7-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide

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

D483-1220

Molecular Formula

C22H22N6O2S (C22 H22 N6 O2 S)

Compound Name

2-{[5-({2,7-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide

IUPAC name

2-{[5-({27-dimethyl-4-oxo-4H-pyrido[12-a]pyrimidin-3-yl}methyl)-4-methyl-4H-124-triazol-3-yl]sulfanyl}-N-phenylacetamide

SMILES

CC(C=CC1=NC(C)=C2Cc(n3C)nnc3SCC(Nc3ccccc3)=O)=CN1C2=O

InChI

InChI=1S/C22H22N6O2S/c1-14-9-10-18-23-15(2)17(21(30)28(18)12-14)11-19-25-26-22(27(19)3)31-13-20(29)24-16-7-5-4-6-8-16/h4-10,12H,11,13H2,1-3H3,(H,24,29)

InChI Key

BIPMDFOVUALDCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14831941

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.52

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

1.659

Distribution Coefficient, logD

1.659

Water Solubility, LogSw

-2.26

Polar Surface Area

74.593

Acid Dissociation Constant (pKa)

12.80

Base Dissociation Constant (pKb)

3.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with D483-1220 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D483-1220?
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What is the minimum amount of D483-1220 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D483-1220
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D483-1220
  • 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 D483-1220 available by request