V020-1038 Screening compound: benzyl 5-(2,5-dimethoxyphenyl)-7-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V020-1038 Screening compound: benzyl 5-(2,5-dimethoxyphenyl)-7-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V020-1038 Screening compound: benzyl 5-(2,5-dimethoxyphenyl)-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 V020-1038
benzyl 5-(2,5-dimethoxyphenyl)-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

V020-1038

Molecular Formula

C29H31N3O6S (C29 H31 N3 O6 S)

Compound Name

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

IUPAC name

benzyl 5-(25-dimethoxyphenyl)-7-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CC(N=C1SC=C(CC(N2CCOCC2)=O)N1C1c(cc(cc2)OC)c2OC)=C1C(OCc1ccccc1)=O

InChI

InChI=1S/C29H31N3O6S/c1-19-26(28(34)38-17-20-7-5-4-6-8-20)27(23-16-22(35-2)9-10-24(23)36-3)32-21(18-39-29(32)30-19)15-25(33)31-11-13-37-14-12-31/h4-10,16,18,27H,11-15,17H2,1-3H3/t27-/m1/s1

InChI Key

JYIVATPBMBWUNR-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD19825558

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

549.65

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.796

Distribution Coefficient, logD

3.795

Water Solubility, LogSw

-4.12

Polar Surface Area

71.718

Acid Dissociation Constant (pKa)

20.21

Base Dissociation Constant (pKb)

3.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.50

V020-1038 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V020-1038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-1038?
Check Price and Availability of V020-1038, 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 V020-1038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-1038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-1038
  • 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 V020-1038 available by request