D082-0559 Screening compound: ethyl 4-{3-[(4-ethylphenyl)carbamoyl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-2-amido}benzoate

D082-0559 Screening compound: ethyl 4-{3-[(4-ethylphenyl)carbamoyl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-2-amido}benzoate
D082-0559 Screening compound: ethyl 4-{3-[(4-ethylphenyl)carbamoyl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-2-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D082-0559
ethyl 4-{3-[(4-ethylphenyl)carbamoyl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-2-amido}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

D082-0559

Molecular Formula

C26H24N4O5S (C26 H24 N4 O5 S)

Compound Name

ethyl 4-{3-[(4-ethylphenyl)carbamoyl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-2-amido}benzoate

IUPAC name

ethyl 4-{3-[(4-ethylphenyl)carbamoyl]-7-methyl-5-oxo-5H-[13]thiazolo[32-a]pyrimidine-2-amido}benzoate

SMILES

CCc(cc1)ccc1NC(C(N12)=C(C(Nc(cc3)ccc3C(OCC)=O)=O)SC2=NC(C)=CC1=O)=O

InChI

InChI=1S/C26H24N4O5S/c1-4-16-6-10-18(11-7-16)28-23(32)21-22(36-26-27-15(3)14-20(31)30(21)26)24(33)29-19-12-8-17(9-13-19)25(34)35-5-2/h6-14H,4-5H2,1-3H3,(H,28,32)(H,29,33)

InChI Key

QKOQJELIUKOWBW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07189579

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

504.57

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.538

Distribution Coefficient, logD

4.272

Water Solubility, LogSw

-4.16

Polar Surface Area

93.012

Acid Dissociation Constant (pKa)

7.47

Base Dissociation Constant (pKb)

-1.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with D082-0559 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D082-0559?
Check Price and Availability of D082-0559, 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 D082-0559 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D082-0559
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D082-0559
  • 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 D082-0559 available by request