F396-0876 Screening compound: N~1~-(2-methoxyphenyl)-2-{[3-(4-methylbenzyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

F396-0876 Screening compound: N~1~-(2-methoxyphenyl)-2-{[3-(4-methylbenzyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
F396-0876 Screening compound: N~1~-(2-methoxyphenyl)-2-{[3-(4-methylbenzyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F396-0876
N~1~-(2-methoxyphenyl)-2-{[3-(4-methylbenzyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

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

F396-0876

Molecular Formula

C26H22N4O3S2 (C26 H22 N4 O3 S2)

Compound Name

N~1~-(2-methoxyphenyl)-2-{[3-(4-methylbenzyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

IUPAC name

N-(2-methoxyphenyl)-2-({5-[(4-methylphenyl)methyl]-6-oxo-8-thia-3510-triazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)31012-pentaen-4-yl}sulfanyl)acetamide

SMILES

Cc1ccc(CN(C2=O)C(SCC(Nc(cccc3)c3OC)=O)=Nc3c2sc2ncccc23)cc1

InChI

InChI=1S/C26H22N4O3S2/c1-16-9-11-17(12-10-16)14-30-25(32)23-22(18-6-5-13-27-24(18)35-23)29-26(30)34-15-21(31)28-19-7-3-4-8-20(19)33-2/h3-13H,14-15H2,1-2H3,(H,28,31)

InChI Key

GJOYAMAMONYTMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27123020

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

502.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.828

Distribution Coefficient, logD

4.828

Water Solubility, LogSw

-4.68

Polar Surface Area

63.753

Acid Dissociation Constant (pKa)

11.57

Base Dissociation Constant (pKb)

2.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with F396-0876 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F396-0876?
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What is the minimum amount of F396-0876 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F396-0876
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F396-0876
  • 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 F396-0876 available by request