D148-0383 Screening compound: ethyl 3-[8-bromo-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate

D148-0383 Screening compound: ethyl 3-[8-bromo-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate
D148-0383 Screening compound: ethyl 3-[8-bromo-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D148-0383
ethyl 3-[8-bromo-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate

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

D148-0383

Molecular Formula

C19H15BrN4O3S (C19 H15 BrN4 O3 S)

Compound Name

ethyl 3-[8-bromo-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate

IUPAC name

ethyl 3-{12-bromo-1113-dimethyl-6-oxo-8-thia-34510-tetraazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)3911-pentaen-5-yl}benzoate

SMILES

CCOC(c1cccc(N(C2=O)N=Nc(c3c4C)c2sc3nc(C)c4Br)c1)=O

InChI

InChI=1S/C19H15BrN4O3S/c1-4-27-19(26)11-6-5-7-12(8-11)24-18(25)16-15(22-23-24)13-9(2)14(20)10(3)21-17(13)28-16/h5-8H,4H2,1-3H3

InChI Key

FJLQERVVXGORLV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14812727

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.32

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.331

Distribution Coefficient, logD

5.331

Water Solubility, LogSw

-5.59

Polar Surface Area

68.312

Acid Dissociation Constant (pKa)

29.19

Base Dissociation Constant (pKb)

0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

D148-0383 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D148-0383 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D148-0383?
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What is the minimum amount of D148-0383 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D148-0383
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D148-0383
  • 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 D148-0383 available by request