V012-2760 Screening compound: methyl 7-ethyl-3-(2-{[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-5-(3-methylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V012-2760 Screening compound: methyl 7-ethyl-3-(2-{[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-5-(3-methylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V012-2760 Screening compound: methyl 7-ethyl-3-(2-{[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-5-(3-methylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-2760
methyl 7-ethyl-3-(2-{[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-5-(3-methylphenyl)-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

V012-2760

Molecular Formula

C29H30N4O3S (C29 H30 N4 O3 S)

Compound Name

methyl 7-ethyl-3-(2-{[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-5-(3-methylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

methyl 7-ethyl-3-({[2-(1H-indol-3-yl)ethyl]carbamoyl}methyl)-5-(3-methylphenyl)-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CCC(N=C1SC=C(CC(NCCc2c[nH]c3c2cccc3)=O)N1C1c2cc(C)ccc2)=C1C(OC)=O

InChI

InChI=1S/C29H30N4O3S/c1-4-23-26(28(35)36-3)27(19-9-7-8-18(2)14-19)33-21(17-37-29(33)32-23)15-25(34)30-13-12-20-16-31-24-11-6-5-10-22(20)24/h5-11,14,16-17,27,31H,4,12-13,15H2,1-3H3,(H,30,34)/t27-/m1/s1

InChI Key

NHWRXDCRYAVRLV-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD19974239

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

514.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.728

Distribution Coefficient, logD

4.727

Water Solubility, LogSw

-4.72

Polar Surface Area

67.350

Acid Dissociation Constant (pKa)

14.53

Base Dissociation Constant (pKb)

4.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.59

V012-2760 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V012-2760 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-2760?
Check Price and Availability of V012-2760, 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 V012-2760 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-2760
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-2760
  • 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 V012-2760 available by request