L858-0253 Screening compound: N~1~-(4-chloro-2-fluorophenyl)-2-[2-ethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl]acetamide

L858-0253 Screening compound: N~1~-(4-chloro-2-fluorophenyl)-2-[2-ethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
L858-0253 Screening compound: N~1~-(4-chloro-2-fluorophenyl)-2-[2-ethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L858-0253
N~1~-(4-chloro-2-fluorophenyl)-2-[2-ethyl-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

L858-0253

Molecular Formula

C19H14ClFN4O2S (C19 H14 ClFN4 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CCC(N(CC(Nc(ccc(Cl)c1)c1F)=O)C1=O)=Nc2c1sc1c2cccn1

InChI

InChI=1S/C19H14ClFN4O2S/c1-2-14-24-16-11-4-3-7-22-18(11)28-17(16)19(27)25(14)9-15(26)23-13-6-5-10(20)8-12(13)21/h3-8H,2,9H2,1H3,(H,23,26)

InChI Key

MZTAKSMXVBQVGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27480959

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.86

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.604

Distribution Coefficient, logD

3.595

Water Solubility, LogSw

-3.98

Polar Surface Area

55.829

Acid Dissociation Constant (pKa)

9.05

Base Dissociation Constant (pKb)

2.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with L858-0253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L858-0253?
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What is the minimum amount of L858-0253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L858-0253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L858-0253
  • 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 L858-0253 available by request