Y041-4845 Screening compound: methyl 5,5-dimethyl-1,3-thiazolidine-4-carboxylate

Y041-4845 Screening compound: methyl 5,5-dimethyl-1,3-thiazolidine-4-carboxylate
Y041-4845 Screening compound: methyl 5,5-dimethyl-1,3-thiazolidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-4845
methyl 5,5-dimethyl-1,3-thiazolidine-4-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

Y041-4845

Molecular Formula

C7H13NO2S (C7 H13 NO2 S)

Compound Name

methyl 5,5-dimethyl-1,3-thiazolidine-4-carboxylate

IUPAC name

methyl 55-dimethyl-13-thiazolidine-4-carboxylate

SMILES

CC1(C)SCNC1C(OC)=O

InChI

InChI=1S/C7H13NO2S/c1-7(2)5(6(9)10-3)8-4-11-7/h5,8H,4H2,1-3H3/t5-/m0/s1

InChI Key

VQAXIQTYFVLHJT-YFKPBYRVSA-N

MDL Number (MFCD)

MFCD09881017

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

175.25

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

0.864

Distribution Coefficient, logD

0.862

Water Solubility, LogSw

-1.59

Polar Surface Area

34.996

Acid Dissociation Constant (pKa)

22.00

Base Dissociation Constant (pKb)

4.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

85.70

Y041-4845 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y041-4845 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-4845?
Check Price and Availability of Y041-4845, 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 Y041-4845 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-4845
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-4845
  • 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 Y041-4845 available by request