V006-4913 Screening compound: 1-{4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazino}-2-methyl-1-butanone

V006-4913 Screening compound: 1-{4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazino}-2-methyl-1-butanone
V006-4913 Screening compound: 1-{4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazino}-2-methyl-1-butanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-4913
1-{4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazino}-2-methyl-1-butanone

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

V006-4913

Molecular Formula

C20H22Cl2N6O (C20 H22 Cl2 N6 O)

Compound Name

1-{4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazino}-2-methyl-1-butanone

IUPAC name

n/a

SMILES

CCC(C)C(N(CC1)CCN1c1nn2c(-c(cc(cc3)Cl)c3Cl)ccnc2n1)=O

InChI

InChI=1S/C20H22Cl2N6O/c1-3-13(2)18(29)26-8-10-27(11-9-26)20-24-19-23-7-6-17(28(19)25-20)15-12-14(21)4-5-16(15)22/h4-7,12-13H,3,8-11H2,1-2H3/t13-/m0/s1

InChI Key

ZHTCNLPZXJKUSR-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD19955191

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.150

Distribution Coefficient, logD

4.147

Water Solubility, LogSw

-4.43

Polar Surface Area

49.320

Acid Dissociation Constant (pKa)

20.67

Base Dissociation Constant (pKb)

8.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with V006-4913 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-4913?
Check Price and Availability of V006-4913, 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 V006-4913 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-4913
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-4913
  • 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 V006-4913 available by request