A0060873 Screening compound: 7-(morpholine-4-carbonyl)-3-pentyl-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

A0060873 Screening compound: 7-(morpholine-4-carbonyl)-3-pentyl-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one
A0060873 Screening compound: 7-(morpholine-4-carbonyl)-3-pentyl-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound A0060873
7-(morpholine-4-carbonyl)-3-pentyl-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-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

A0060873

Molecular Formula

C18H23N3O3S (C18 H23 N3 O3 S)

Compound Name

7-(morpholine-4-carbonyl)-3-pentyl-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

IUPAC name

7-(morpholine-4-carbonyl)-3-pentyl-2-sulfanylidene-1234-tetrahydroquinazolin-4-one

SMILES

CCCCCN(C(c(ccc(C(N1CCOCC1)=O)c1)c1N1)=O)C1=S

InChI

InChI=1S/C18H23N3O3S/c1-2-3-4-7-21-17(23)14-6-5-13(12-15(14)19-18(21)25)16(22)20-8-10-24-11-9-20/h5-6,12H,2-4,7-11H2,1H3,(H,19,25)

InChI Key

NBFGIUMCVOFIIV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02111407

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.557

Distribution Coefficient, logD

2.557

Water Solubility, LogSw

-3.17

Polar Surface Area

52.125

Acid Dissociation Constant (pKa)

10.33

Base Dissociation Constant (pKb)

-4.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

A0060873 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with A0060873 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound A0060873?
Check Price and Availability of A0060873, 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 A0060873 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for A0060873
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for A0060873
  • 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 A0060873 available by request