V019-9926 Screening compound: ethyl 5-[3-(benzyloxy)phenyl]-7-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V019-9926 Screening compound: ethyl 5-[3-(benzyloxy)phenyl]-7-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V019-9926 Screening compound: ethyl 5-[3-(benzyloxy)phenyl]-7-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-9926
ethyl 5-[3-(benzyloxy)phenyl]-7-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-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

V019-9926

Molecular Formula

C29H31N3O5S (C29 H31 N3 O5 S)

Compound Name

ethyl 5-[3-(benzyloxy)phenyl]-7-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

ethyl 5-[3-(benzyloxy)phenyl]-7-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CCOC(C1=C(C)N=C2SC=C(CC(N3CCOCC3)=O)N2C1c1cc(OCc2ccccc2)ccc1)=O

InChI

InChI=1S/C29H31N3O5S/c1-3-36-28(34)26-20(2)30-29-32(23(19-38-29)17-25(33)31-12-14-35-15-13-31)27(26)22-10-7-11-24(16-22)37-18-21-8-5-4-6-9-21/h4-11,16,19,27H,3,12-15,17-18H2,1-2H3/t27-/m1/s1

InChI Key

ZPFPUQDVVJMNGE-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD19821000

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.994

Distribution Coefficient, logD

3.993

Water Solubility, LogSw

-4.15

Polar Surface Area

63.667

Acid Dissociation Constant (pKa)

20.21

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.50

V019-9926 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V019-9926 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-9926?
Check Price and Availability of V019-9926, 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 V019-9926 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-9926
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-9926
  • 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 V019-9926 available by request