8019-0300 Screening compound: 8-methyl-2-(morpholin-4-yl)-4-(pyridin-3-yl)-1H,4H,6H-pyrimido[1,2-a][1,3,5]triazin-6-one

8019-0300 Screening compound: 8-methyl-2-(morpholin-4-yl)-4-(pyridin-3-yl)-1H,4H,6H-pyrimido[1,2-a][1,3,5]triazin-6-one
8019-0300 Screening compound: 8-methyl-2-(morpholin-4-yl)-4-(pyridin-3-yl)-1H,4H,6H-pyrimido[1,2-a][1,3,5]triazin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-0300
8-methyl-2-(morpholin-4-yl)-4-(pyridin-3-yl)-1H,4H,6H-pyrimido[1,2-a][1,3,5]triazin-6-one

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

8019-0300

Molecular Formula

C16H18N6O2 (C16 H18 N6 O2)

Compound Name

8-methyl-2-(morpholin-4-yl)-4-(pyridin-3-yl)-1H,4H,6H-pyrimido[1,2-a][1,3,5]triazin-6-one

IUPAC name

8-methyl-2-(morpholin-4-yl)-4-(pyridin-3-yl)-1H4H6H-pyrimido[12-a][135]triazin-6-one

SMILES

CC(N=C(N1)N2C(c3cnccc3)N=C1N1CCOCC1)=CC2=O

InChI

InChI=1S/C16H18N6O2/c1-11-9-13(23)22-14(12-3-2-4-17-10-12)19-15(20-16(22)18-11)21-5-7-24-8-6-21/h2-4,9-10,14H,5-8H2,1H3,(H,18,19,20)/t14-/m1/s1

InChI Key

SZBFSWQSSHQCIQ-CQSZACIVSA-N

MDL Number (MFCD)

MFCD08592658

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.335

Distribution Coefficient, logD

-3.019

Water Solubility, LogSw

-1.01

Polar Surface Area

68.296

Acid Dissociation Constant (pKa)

13.05

Base Dissociation Constant (pKb)

8.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

8019-0300 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

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

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 8019-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-0300?
Check Price and Availability of 8019-0300, 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 8019-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-0300
  • 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 8019-0300 available by request