V008-0834 Screening compound: 2-{6-[1-(2-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide

V008-0834 Screening compound: 2-{6-[1-(2-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
V008-0834 Screening compound: 2-{6-[1-(2-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-0834
2-{6-[1-(2-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide

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

V008-0834

Molecular Formula

C29H28ClN5O4S (C29 H28 ClN5 O4 S)

Compound Name

2-{6-[1-(2-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide

IUPAC name

2-{6-[1-(2-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[13]thiazolo[32-a]pyrimidin-3-yl}-N-[2-(34-dimethoxyphenyl)ethyl]acetamide

SMILES

Cc1cc(C2=C(C)N=C3SC=C(CC(NCCc(cc4)cc(OC)c4OC)=O)N3C2=O)nn1-c(cccc1)c1Cl

InChI

InChI=1S/C29H28ClN5O4S/c1-17-13-22(33-35(17)23-8-6-5-7-21(23)30)27-18(2)32-29-34(28(27)37)20(16-40-29)15-26(36)31-12-11-19-9-10-24(38-3)25(14-19)39-4/h5-10,13-14,16H,11-12,15H2,1-4H3,(H,31,36)

InChI Key

ZZXYRXQYNZNGHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19856002

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

578.09

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.047

Distribution Coefficient, logD

3.047

Water Solubility, LogSw

-3.45

Polar Surface Area

77.926

Acid Dissociation Constant (pKa)

14.96

Base Dissociation Constant (pKb)

1.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.10

V008-0834 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V008-0834 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-0834?
Check Price and Availability of V008-0834, 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 V008-0834 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-0834
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-0834
  • 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 V008-0834 available by request