Y501-1783 Screening compound: {5-[9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-2-furyl}methyl (2,5-dimethylphenyl) ether

Y501-1783 Screening compound: {5-[9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-2-furyl}methyl (2,5-dimethylphenyl) ether
Y501-1783 Screening compound: {5-[9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-2-furyl}methyl (2,5-dimethylphenyl) ether alternative view

Chemical Structure Depiction of ChemDiv screening compound Y501-1783
{5-[9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-2-furyl}methyl (2,5-dimethylphenyl) ether

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

Y501-1783

Molecular Formula

C25H19F2N5O2S (C25 H19 F2 N5 O2 S)

Compound Name

{5-[9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-2-furyl}methyl (2,5-dimethylphenyl) ether

IUPAC name

13-(difluoromethyl)-4-{5-[(25-dimethylphenoxy)methyl]furan-2-yl}-11-methyl-16-thia-356814-pentaazatetracyclo[7.7.0.0^{26}.0^{1015}]hexadeca-1(9)24710(15)1113-heptaene

SMILES

Cc1cc(OCc2ccc(-c3nn(cnc4c5sc6nc(C(F)F)cc(C)c46)c5n3)o2)c(C)cc1

InChI

InChI=1S/C25H19F2N5O2S/c1-12-4-5-13(2)18(8-12)33-10-15-6-7-17(34-15)23-30-24-21-20(28-11-32(24)31-23)19-14(3)9-16(22(26)27)29-25(19)35-21/h4-9,11,22H,10H2,1-3H3

InChI Key

AMUDOWMYXYCHGV-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.272

Distribution Coefficient, logD

6.268

Water Solubility, LogSw

-5.91

Polar Surface Area

55.376

Acid Dissociation Constant (pKa)

23.64

Base Dissociation Constant (pKb)

5.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

Y501-1783 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y501-1783 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-1783?
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What is the minimum amount of Y501-1783 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-1783
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-1783
  • 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 Y501-1783 available by request