F880-0442 Screening compound: N-{2-[({7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}propanamide

F880-0442 Screening compound: N-{2-[({7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}propanamide
F880-0442 Screening compound: N-{2-[({7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F880-0442
N-{2-[({7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}propanamide

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

F880-0442

Molecular Formula

C19H19N3O2S (C19 H19 N3 O2 S)

Compound Name

N-{2-[({7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}propanamide

IUPAC name

N-{2-[({7-methyl-4-oxo-4H-pyrido[12-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}propanamide

SMILES

CCC(Nc(cccc1)c1SCC(N=C1N2C=C(C)C=C1)=CC2=O)=O

InChI

InChI=1S/C19H19N3O2S/c1-3-18(23)21-15-6-4-5-7-16(15)25-12-14-10-19(24)22-11-13(2)8-9-17(22)20-14/h4-11H,3,12H2,1-2H3,(H,21,23)

InChI Key

YTJVIYVWRYEYAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14969863

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.245

Distribution Coefficient, logD

2.245

Water Solubility, LogSw

-2.65

Polar Surface Area

48.924

Acid Dissociation Constant (pKa)

12.43

Base Dissociation Constant (pKb)

3.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

References: we are preparing a list of scientific research reports with F880-0442 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F880-0442?
Check Price and Availability of F880-0442, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F880-0442 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F880-0442
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F880-0442
  • 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 F880-0442 available by request