6000-0368 Screening compound: (5Z)-5-({4-oxo-2-[(prop-2-en-1-yl)amino]-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-3-propyl-1,3-thiazolidine-2,4-dione

6000-0368 Screening compound: (5Z)-5-({4-oxo-2-[(prop-2-en-1-yl)amino]-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-3-propyl-1,3-thiazolidine-2,4-dione
6000-0368 Screening compound: (5Z)-5-({4-oxo-2-[(prop-2-en-1-yl)amino]-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-3-propyl-1,3-thiazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 6000-0368
(5Z)-5-({4-oxo-2-[(prop-2-en-1-yl)amino]-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-3-propyl-1,3-thiazolidine-2,4-dione

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

6000-0368

Molecular Formula

C18H18N4O3S (C18 H18 N4 O3 S)

Compound Name

(5Z)-5-({4-oxo-2-[(prop-2-en-1-yl)amino]-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-3-propyl-1,3-thiazolidine-2,4-dione

IUPAC name

(5Z)-5-({4-oxo-2-[(prop-2-en-1-yl)amino]-4H-pyrido[12-a]pyrimidin-3-yl}methylidene)-3-propyl-13-thiazolidine-24-dione

SMILES

CCCN(C(/C(/S1)=C/C2=C(NCC=C)N=C(C=CC=C3)N3C2=O)=O)C1=O

InChI

InChI=1S/C18H18N4O3S/c1-3-8-19-15-12(16(23)21-10-6-5-7-14(21)20-15)11-13-17(24)22(9-4-2)18(25)26-13/h3,5-7,10-11,19H,1,4,8-9H2,2H3

InChI Key

WHOSUOJCBCIWAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03828334

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.127

Distribution Coefficient, logD

2.126

Water Solubility, LogSw

-2.31

Polar Surface Area

64.702

Acid Dissociation Constant (pKa)

10.32

Base Dissociation Constant (pKb)

1.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with 6000-0368 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6000-0368?
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What is the minimum amount of 6000-0368 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6000-0368
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6000-0368
  • 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 6000-0368 available by request