V019-3457 Screening compound: ethyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-7-(trifluoromethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V019-3457 Screening compound: ethyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-7-(trifluoromethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V019-3457 Screening compound: ethyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-7-(trifluoromethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-3457
ethyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-7-(trifluoromethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-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

V019-3457

Molecular Formula

C25H27F3N4O4S (C25 H27 F3 N4 O4 S)

Compound Name

ethyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-7-(trifluoromethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

ethyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-7-(trifluoromethyl)-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CCOC(C1=C(C(F)(F)F)N=C2SC=C(CC(N(CC3)CCN3C(C)=O)=O)N2C1c1ccc(C)cc1)=O

InChI

InChI=1S/C25H27F3N4O4S/c1-4-36-23(35)20-21(17-7-5-15(2)6-8-17)32-18(14-37-24(32)29-22(20)25(26,27)28)13-19(34)31-11-9-30(10-12-31)16(3)33/h5-8,14,21H,4,9-13H2,1-3H3/t21-/m1/s1

InChI Key

MWUSXJZGCVMLRW-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD19825426

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

536.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.648

Distribution Coefficient, logD

3.646

Water Solubility, LogSw

-3.62

Polar Surface Area

66.228

Acid Dissociation Constant (pKa)

20.21

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.00

References: we are preparing a list of scientific research reports with V019-3457 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-3457?
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What is the minimum amount of V019-3457 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-3457
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-3457
  • 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 V019-3457 available by request