V001-8812 Screening compound: 1-{6-benzyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}-4-(2,4-dichlorobenzoyl)piperazine

V001-8812 Screening compound: 1-{6-benzyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}-4-(2,4-dichlorobenzoyl)piperazine
V001-8812 Screening compound: 1-{6-benzyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}-4-(2,4-dichlorobenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-8812
1-{6-benzyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}-4-(2,4-dichlorobenzoyl)piperazine

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

V001-8812

Molecular Formula

C24H22Cl2N6O (C24 H22 Cl2 N6 O)

Compound Name

1-{6-benzyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}-4-(2,4-dichlorobenzoyl)piperazine

IUPAC name

1-{6-benzyl-5-methyl-[124]triazolo[15-a]pyrimidin-7-yl}-4-(24-dichlorobenzoyl)piperazine

SMILES

Cc1nc2ncnn2c(N(CC2)CCN2C(c(ccc(Cl)c2)c2Cl)=O)c1Cc1ccccc1

InChI

InChI=1S/C24H22Cl2N6O/c1-16-20(13-17-5-3-2-4-6-17)22(32-24(29-16)27-15-28-32)30-9-11-31(12-10-30)23(33)19-8-7-18(25)14-21(19)26/h2-8,14-15H,9-13H2,1H3

InChI Key

PCRBMOANGWIMAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19960690

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

481.38

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

4.527

Distribution Coefficient, logD

4.491

Water Solubility, LogSw

-4.72

Polar Surface Area

50.760

Acid Dissociation Constant (pKa)

21.64

Base Dissociation Constant (pKb)

6.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with V001-8812 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-8812?
Check Price and Availability of V001-8812, 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 V001-8812 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-8812
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-8812
  • 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 V001-8812 available by request