D278-1266 Screening compound: methyl 2-[2-({5,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)acetamido]benzoate

D278-1266 Screening compound: methyl 2-[2-({5,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)acetamido]benzoate
D278-1266 Screening compound: methyl 2-[2-({5,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)acetamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D278-1266
methyl 2-[2-({5,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)acetamido]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

D278-1266

Molecular Formula

C23H22N4O3S (C23 H22 N4 O3 S)

Compound Name

methyl 2-[2-({5,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)acetamido]benzoate

IUPAC name

methyl 2-[2-({579-trimethyl-[124]triazolo[43-a]quinolin-1-yl}sulfanyl)acetamido]benzoate

SMILES

Cc(cc1C)cc2c1n1c(SCC(Nc(cccc3)c3C(OC)=O)=O)nnc1cc2C

InChI

InChI=1S/C23H22N4O3S/c1-13-9-15(3)21-17(10-13)14(2)11-19-25-26-23(27(19)21)31-12-20(28)24-18-8-6-5-7-16(18)22(29)30-4/h5-11H,12H2,1-4H3,(H,24,28)

InChI Key

DWEUDWJRFIGXCE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04904114

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.784

Distribution Coefficient, logD

4.771

Water Solubility, LogSw

-4.55

Polar Surface Area

64.483

Acid Dissociation Constant (pKa)

8.92

Base Dissociation Constant (pKb)

2.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

D278-1266 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 D278-1266 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D278-1266?
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What is the minimum amount of D278-1266 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D278-1266
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D278-1266
  • 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 D278-1266 available by request