Y070-3308 Screening compound: (5Z)-3-butyl-5-{[9-methyl-4-oxo-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one

Y070-3308 Screening compound: (5Z)-3-butyl-5-{[9-methyl-4-oxo-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Y070-3308 Screening compound: (5Z)-3-butyl-5-{[9-methyl-4-oxo-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-3308
(5Z)-3-butyl-5-{[9-methyl-4-oxo-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-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

Y070-3308

Molecular Formula

C23H21N3O2S3 (C23 H21 N3 O2 S3)

Compound Name

(5Z)-3-butyl-5-{[9-methyl-4-oxo-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

(5Z)-3-butyl-5-{[9-methyl-4-oxo-2-(phenylsulfanyl)-4H-pyrido[12-a]pyrimidin-3-yl]methylidene}-2-sulfanylidene-13-thiazolidin-4-one

SMILES

CCCCN(C(/C(/S1)=C/C(C(N(C=CC=C2C)C2=N2)=O)=C2Sc2ccccc2)=O)C1=S

InChI

InChI=1S/C23H21N3O2S3/c1-3-4-12-26-22(28)18(31-23(26)29)14-17-20(30-16-10-6-5-7-11-16)24-19-15(2)9-8-13-25(19)21(17)27/h5-11,13-14H,3-4,12H2,1-2H3

InChI Key

OATHBQAZDHSABV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03212859

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.64

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.053

Distribution Coefficient, logD

5.053

Water Solubility, LogSw

-4.51

Polar Surface Area

40.031

Acid Dissociation Constant (pKa)

28.32

Base Dissociation Constant (pKb)

-1.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with Y070-3308 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-3308?
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What is the minimum amount of Y070-3308 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-3308
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-3308
  • 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 Y070-3308 available by request