L858-0043 Screening compound: N~1~-(4-bromophenyl)-2-[2-methyl-4-oxopyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl]acetamide

L858-0043 Screening compound: N~1~-(4-bromophenyl)-2-[2-methyl-4-oxopyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
L858-0043 Screening compound: N~1~-(4-bromophenyl)-2-[2-methyl-4-oxopyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L858-0043
N~1~-(4-bromophenyl)-2-[2-methyl-4-oxopyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl]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

L858-0043

Molecular Formula

C18H13BrN4O2S (C18 H13 BrN4 O2 S)

Compound Name

N~1~-(4-bromophenyl)-2-[2-methyl-4-oxopyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl]acetamide

IUPAC name

N-(4-bromophenyl)-2-{4-methyl-6-oxo-8-thia-3510-triazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)3911-pentaen-5-yl}acetamide

SMILES

CC(N(CC(Nc(cc1)ccc1Br)=O)C1=O)=Nc2c1sc1c2cccn1

InChI

InChI=1S/C18H13BrN4O2S/c1-10-21-15-13-3-2-8-20-17(13)26-16(15)18(25)23(10)9-14(24)22-12-6-4-11(19)5-7-12/h2-8H,9H2,1H3,(H,22,24)

InChI Key

TXAYPVMUEOMMBZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27480900

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.480

Distribution Coefficient, logD

3.480

Water Solubility, LogSw

-3.70

Polar Surface Area

55.435

Acid Dissociation Constant (pKa)

10.94

Base Dissociation Constant (pKb)

2.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

L858-0043 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L858-0043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L858-0043?
Check Price and Availability of L858-0043, 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 L858-0043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L858-0043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L858-0043
  • 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 L858-0043 available by request