V020-1061 Screening compound: benzyl 5-(2,5-dimethoxyphenyl)-7-methyl-3-({[2-(morpholin-4-yl)ethyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V020-1061 Screening compound: benzyl 5-(2,5-dimethoxyphenyl)-7-methyl-3-({[2-(morpholin-4-yl)ethyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V020-1061 Screening compound: benzyl 5-(2,5-dimethoxyphenyl)-7-methyl-3-({[2-(morpholin-4-yl)ethyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-1061
benzyl 5-(2,5-dimethoxyphenyl)-7-methyl-3-({[2-(morpholin-4-yl)ethyl]carbamoyl}methyl)-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

V020-1061

Molecular Formula

C31H36N4O6S (C31 H36 N4 O6 S)

Compound Name

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

IUPAC name

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

SMILES

CC(N=C1SC=C(CC(NCCN2CCOCC2)=O)N1C1c(cc(cc2)OC)c2OC)=C1C(OCc1ccccc1)=O

InChI

InChI=1S/C31H36N4O6S/c1-21-28(30(37)41-19-22-7-5-4-6-8-22)29(25-18-24(38-2)9-10-26(25)39-3)35-23(20-42-31(35)33-21)17-27(36)32-11-12-34-13-15-40-16-14-34/h4-10,18,20,29H,11-17,19H2,1-3H3,(H,32,36)/t29-/m1/s1

InChI Key

REZVCAADGDJRNE-GDLZYMKVSA-N

MDL Number (MFCD)

MFCD19829058

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

592.72

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.204

Distribution Coefficient, logD

3.117

Water Solubility, LogSw

-3.39

Polar Surface Area

83.621

Acid Dissociation Constant (pKa)

14.01

Base Dissociation Constant (pKb)

6.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.70

V020-1061 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 V020-1061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-1061?
Check Price and Availability of V020-1061, 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 V020-1061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-1061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-1061
  • 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 V020-1061 available by request