Y070-2335 Screening compound: (5Z)-3-cyclopentyl-5-({9-methyl-2-[(2-methylpropyl)amino]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

Y070-2335 Screening compound: (5Z)-3-cyclopentyl-5-({9-methyl-2-[(2-methylpropyl)amino]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Y070-2335 Screening compound: (5Z)-3-cyclopentyl-5-({9-methyl-2-[(2-methylpropyl)amino]-4-oxo-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 Y070-2335
(5Z)-3-cyclopentyl-5-({9-methyl-2-[(2-methylpropyl)amino]-4-oxo-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

Y070-2335

Molecular Formula

C22H26N4O2S2 (C22 H26 N4 O2 S2)

Compound Name

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

IUPAC name

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

SMILES

CC(C)CNC(N=C1N2C=CC=C1C)=C(/C=C(/C(N1C3CCCC3)=O)\SC1=S)C2=O

InChI

InChI=1S/C22H26N4O2S2/c1-13(2)12-23-18-16(20(27)25-10-6-7-14(3)19(25)24-18)11-17-21(28)26(22(29)30-17)15-8-4-5-9-15/h6-7,10-11,13,15,23H,4-5,8-9,12H2,1-3H3

InChI Key

DSBIQHBFNAOKTR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03690413

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.571

Distribution Coefficient, logD

3.571

Water Solubility, LogSw

-3.83

Polar Surface Area

50.065

Acid Dissociation Constant (pKa)

12.02

Base Dissociation Constant (pKb)

1.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

Y070-2335 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y070-2335 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-2335?
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What is the minimum amount of Y070-2335 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-2335
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-2335
  • 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 Y070-2335 available by request