8018-4551 Screening compound: 6,7-dimethyl-2-oxo-2,3-dihydro[1,3]thiazolo[4,5-b]pyridin-5-yl acetate

8018-4551 Screening compound: 6,7-dimethyl-2-oxo-2,3-dihydro[1,3]thiazolo[4,5-b]pyridin-5-yl acetate
8018-4551 Screening compound: 6,7-dimethyl-2-oxo-2,3-dihydro[1,3]thiazolo[4,5-b]pyridin-5-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-4551
6,7-dimethyl-2-oxo-2,3-dihydro[1,3]thiazolo[4,5-b]pyridin-5-yl acetate

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

8018-4551

Molecular Formula

C10H10N2O3S (C10 H10 N2 O3 S)

Compound Name

6,7-dimethyl-2-oxo-2,3-dihydro[1,3]thiazolo[4,5-b]pyridin-5-yl acetate

IUPAC name

67-dimethyl-2-oxo-2H3H-[13]thiazolo[45-b]pyridin-5-yl acetate

SMILES

CC(Oc(nc1N2)c(C)c(C)c1SC2=O)=O

InChI

InChI=1S/C10H10N2O3S/c1-4-5(2)9(15-6(3)13)11-8-7(4)16-10(14)12-8/h1-3H3,(H,11,12,14)

InChI Key

PANCSZMILMZGBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07658903

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

238.27

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.856

Distribution Coefficient, logD

1.851

Water Solubility, LogSw

-2.30

Polar Surface Area

55.086

Acid Dissociation Constant (pKa)

9.31

Base Dissociation Constant (pKb)

-3.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

8018-4551 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 8018-4551 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-4551?
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What is the minimum amount of 8018-4551 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-4551
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-4551
  • 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 8018-4551 available by request