2276-0036 Screening compound: methyl 2-acetamido-4-methyl-1,3-thiazole-5-carboxylate

2276-0036 Screening compound: methyl 2-acetamido-4-methyl-1,3-thiazole-5-carboxylate
2276-0036 Screening compound: methyl 2-acetamido-4-methyl-1,3-thiazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2276-0036
methyl 2-acetamido-4-methyl-1,3-thiazole-5-carboxylate

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

2276-0036

Molecular Formula

C8H10N2O3S (C8 H10 N2 O3 S)

Compound Name

methyl 2-acetamido-4-methyl-1,3-thiazole-5-carboxylate

IUPAC name

methyl 2-acetamido-4-methyl-13-thiazole-5-carboxylate

SMILES

CC(Nc1nc(C)c(C(OC)=O)s1)=O

InChI

InChI=1S/C8H10N2O3S/c1-4-6(7(12)13-3)14-8(9-4)10-5(2)11/h1-3H3,(H,9,10,11)

InChI Key

NXPOFTNIZGJYJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01527763

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

214.25

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.307

Distribution Coefficient, logD

1.278

Water Solubility, LogSw

-1.89

Polar Surface Area

55.297

Acid Dissociation Constant (pKa)

8.56

Base Dissociation Constant (pKb)

-0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

2276-0036 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 2276-0036 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2276-0036?
Check Price and Availability of 2276-0036, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 2276-0036 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2276-0036
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2276-0036
  • 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 2276-0036 available by request