V018-7336 Screening compound: 5-(4-methoxyphenyl)-7-(3-methylpiperidino)[1,2,4]triazolo[1,5-a]pyrimidine

V018-7336 Screening compound: 5-(4-methoxyphenyl)-7-(3-methylpiperidino)[1,2,4]triazolo[1,5-a]pyrimidine
V018-7336 Screening compound: 5-(4-methoxyphenyl)-7-(3-methylpiperidino)[1,2,4]triazolo[1,5-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-7336
5-(4-methoxyphenyl)-7-(3-methylpiperidino)[1,2,4]triazolo[1,5-a]pyrimidine

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

V018-7336

Molecular Formula

C18H21N5O (C18 H21 N5 O)

Compound Name

5-(4-methoxyphenyl)-7-(3-methylpiperidino)[1,2,4]triazolo[1,5-a]pyrimidine

IUPAC name

1-[5-(4-methoxyphenyl)-[124]triazolo[15-a]pyrimidin-7-yl]-3-methylpiperidine

SMILES

CC(CCC1)CN1c1cc(-c(cc2)ccc2OC)nc2ncnn12

InChI

InChI=1S/C18H21N5O/c1-13-4-3-9-22(11-13)17-10-16(21-18-19-12-20-23(17)18)14-5-7-15(24-2)8-6-14/h5-8,10,12-13H,3-4,9,11H2,1-2H3/t13-/m0/s1

InChI Key

ZQVWQWKFYFLHKF-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD19956796

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

323.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.775

Distribution Coefficient, logD

3.756

Water Solubility, LogSw

-3.94

Polar Surface Area

41.729

Acid Dissociation Constant (pKa)

24.67

Base Dissociation Constant (pKb)

6.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.90

V018-7336 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V018-7336 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-7336?
Check Price and Availability of V018-7336, 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 V018-7336 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-7336
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-7336
  • 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 V018-7336 available by request