F399-0212 Screening compound: 3-(2-chlorobenzyl)-2-[(3-fluorobenzyl)sulfanyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one

F399-0212 Screening compound: 3-(2-chlorobenzyl)-2-[(3-fluorobenzyl)sulfanyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
F399-0212 Screening compound: 3-(2-chlorobenzyl)-2-[(3-fluorobenzyl)sulfanyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F399-0212
3-(2-chlorobenzyl)-2-[(3-fluorobenzyl)sulfanyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-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

F399-0212

Molecular Formula

C23H15ClFN3OS2 (C23 H15 ClFN3 OS2)

Compound Name

3-(2-chlorobenzyl)-2-[(3-fluorobenzyl)sulfanyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one

IUPAC name

5-[(2-chlorophenyl)methyl]-4-{[(3-fluorophenyl)methyl]sulfanyl}-8-thia-3510-triazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)31012-pentaen-6-one

SMILES

O=C1N(Cc(cccc2)c2Cl)C(SCc2cc(F)ccc2)=Nc2c1sc1c2cccn1

InChI

InChI=1S/C23H15ClFN3OS2/c24-18-9-2-1-6-15(18)12-28-22(29)20-19(17-8-4-10-26-21(17)31-20)27-23(28)30-13-14-5-3-7-16(25)11-14/h1-11H,12-13H2

InChI Key

MUEVSKMFIDSINC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27123509

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.97

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.860

Distribution Coefficient, logD

5.860

Water Solubility, LogSw

-6.19

Polar Surface Area

33.671

Acid Dissociation Constant (pKa)

31.68

Base Dissociation Constant (pKb)

2.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

References: we are preparing a list of scientific research reports with F399-0212 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F399-0212?
Check Price and Availability of F399-0212, 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 F399-0212 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F399-0212
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F399-0212
  • 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 F399-0212 available by request