V003-6043 Screening compound: 1-(3-chlorobenzoyl)-4-{7-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazine

V003-6043 Screening compound: 1-(3-chlorobenzoyl)-4-{7-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazine
V003-6043 Screening compound: 1-(3-chlorobenzoyl)-4-{7-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-6043
1-(3-chlorobenzoyl)-4-{7-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}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

V003-6043

Molecular Formula

C23H18ClF3N6O (C23 H18 ClF3 N6 O)

Compound Name

1-(3-chlorobenzoyl)-4-{7-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperazine

IUPAC name

1-(3-chlorobenzoyl)-4-{7-[3-(trifluoromethyl)phenyl]-[124]triazolo[15-a]pyrimidin-2-yl}piperazine

SMILES

O=C(c1cccc(Cl)c1)N(CC1)CCN1c1nn2c(-c3cc(C(F)(F)F)ccc3)ccnc2n1

InChI

InChI=1S/C23H18ClF3N6O/c24-18-6-2-4-16(14-18)20(34)31-9-11-32(12-10-31)22-29-21-28-8-7-19(33(21)30-22)15-3-1-5-17(13-15)23(25,26)27/h1-8,13-14H,9-12H2

InChI Key

YHPHDWXHFNSAIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19955118

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

486.88

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

4.363

Distribution Coefficient, logD

4.363

Water Solubility, LogSw

-4.60

Polar Surface Area

49.049

Acid Dissociation Constant (pKa)

20.52

Base Dissociation Constant (pKb)

8.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with V003-6043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-6043?
Check Price and Availability of V003-6043, 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 V003-6043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-6043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-6043
  • 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 V003-6043 available by request