V016-6837 Screening compound: 1-cyclobutanecarbonyl-2-methyl-4-[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine

V016-6837 Screening compound: 1-cyclobutanecarbonyl-2-methyl-4-[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine
V016-6837 Screening compound: 1-cyclobutanecarbonyl-2-methyl-4-[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-6837
1-cyclobutanecarbonyl-2-methyl-4-[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-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

V016-6837

Molecular Formula

C26H28N6O (C26 H28 N6 O)

Compound Name

1-cyclobutanecarbonyl-2-methyl-4-[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine

IUPAC name

1-cyclobutanecarbonyl-2-methyl-4-[3-(4-methylphenyl)-[124]triazolo[43-c]quinazolin-5-yl]piperazine

SMILES

CC(CN(CC1)c2nc(cccc3)c3c3nnc(-c4ccc(C)cc4)n23)N1C(C1CCC1)=O

InChI

InChI=1S/C26H28N6O/c1-17-10-12-19(13-11-17)23-28-29-24-21-8-3-4-9-22(21)27-26(32(23)24)30-14-15-31(18(2)16-30)25(33)20-6-5-7-20/h3-4,8-13,18,20H,5-7,14-16H2,1-2H3/t18-/m0/s1

InChI Key

QXBRTICXPVTWEG-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19923611

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

440.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.327

Distribution Coefficient, logD

4.266

Water Solubility, LogSw

-4.26

Polar Surface Area

49.191

Acid Dissociation Constant (pKa)

21.09

Base Dissociation Constant (pKb)

6.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with V016-6837 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-6837?
Check Price and Availability of V016-6837, 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 V016-6837 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-6837
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-6837
  • 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 V016-6837 available by request