D643-0014 Screening compound: 4-(7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-2,6-dimethoxyphenyl methyl ether

D643-0014 Screening compound: 4-(7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-2,6-dimethoxyphenyl methyl ether
D643-0014 Screening compound: 4-(7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-2,6-dimethoxyphenyl methyl ether alternative view

Chemical Structure Depiction of ChemDiv screening compound D643-0014
4-(7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-2,6-dimethoxyphenyl methyl ether

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

D643-0014

Molecular Formula

C21H19N5O3S (C21 H19 N5 O3 S)

Compound Name

4-(7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-2,6-dimethoxyphenyl methyl ether

IUPAC name

1113-dimethyl-4-(345-trimethoxyphenyl)-16-thia-356814-pentaazatetracyclo[7.7.0.0^{26}.0^{1015}]hexadeca-1(9)247101214-heptaene

SMILES

Cc1c(c(ncn2nc(-c(cc3OC)cc(OC)c3OC)nc22)c2s2)c2nc(C)c1

InChI

InChI=1S/C21H19N5O3S/c1-10-6-11(2)23-21-15(10)16-18(30-21)20-24-19(25-26(20)9-22-16)12-7-13(27-3)17(29-5)14(8-12)28-4/h6-9H,1-5H3

InChI Key

AJFADFKDXKEVGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14856485

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.786

Distribution Coefficient, logD

3.489

Water Solubility, LogSw

-4.11

Polar Surface Area

63.005

Acid Dissociation Constant (pKa)

28.83

Base Dissociation Constant (pKb)

7.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with D643-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D643-0014?
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What is the minimum amount of D643-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D643-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D643-0014
  • 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 D643-0014 available by request