D527-0301 Screening compound: N-butyl-3-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide

D527-0301 Screening compound: N-butyl-3-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
D527-0301 Screening compound: N-butyl-3-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D527-0301
N-butyl-3-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide

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

D527-0301

Molecular Formula

C22H27N5O2 (C22 H27 N5 O2)

Compound Name

N-butyl-3-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide

IUPAC name

N-butyl-3-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H7H-[124]triazolo[15-a]pyrimidin-6-yl]propanamide

SMILES

CCCCNC(CCC1=C(C)N(CC=C)c2nc(-c3ccccc3)nn2C1=O)=O

InChI

InChI=1S/C22H27N5O2/c1-4-6-14-23-19(28)13-12-18-16(3)26(15-5-2)22-24-20(25-27(22)21(18)29)17-10-8-7-9-11-17/h5,7-11H,2,4,6,12-15H2,1,3H3,(H,23,28)

InChI Key

VIZPVDICDVXMSW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27591148

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.312

Distribution Coefficient, logD

3.312

Water Solubility, LogSw

-3.42

Polar Surface Area

63.045

Acid Dissociation Constant (pKa)

14.25

Base Dissociation Constant (pKb)

-0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with D527-0301 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D527-0301?
Check Price and Availability of D527-0301, 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 D527-0301 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D527-0301
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D527-0301
  • 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 D527-0301 available by request