8451-07221 Screening compound: {[7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]carbamoyl}methyl morpholine-4-carbodithioate

8451-07221 Screening compound: {[7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]carbamoyl}methyl morpholine-4-carbodithioate
8451-07221 Screening compound: {[7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]carbamoyl}methyl morpholine-4-carbodithioate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8451-07221
{[7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]carbamoyl}methyl morpholine-4-carbodithioate

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

8451-07221

Molecular Formula

C19H20N4O4S2 (C19 H20 N4 O4 S2)

Compound Name

{[7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]carbamoyl}methyl morpholine-4-carbodithioate

IUPAC name

{[7-(furan-2-yl)-5-oxo-5678-tetrahydroquinazolin-2-yl]carbamoyl}methyl morpholine-4-carbodithioate

SMILES

O=C(CSC(N1CCOCC1)=S)Nc(nc1)nc(CC(C2)c3ccco3)c1C2=O

InChI

InChI=1S/C19H20N4O4S2/c24-15-9-12(16-2-1-5-27-16)8-14-13(15)10-20-18(21-14)22-17(25)11-29-19(28)23-3-6-26-7-4-23/h1-2,5,10,12H,3-4,6-9,11H2,(H,20,21,22,25)/t12-/m1/s1

InChI Key

BFANXKFXQACWJZ-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD04190129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.52

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.812

Distribution Coefficient, logD

1.717

Water Solubility, LogSw

-2.52

Polar Surface Area

77.320

Acid Dissociation Constant (pKa)

8.02

Base Dissociation Constant (pKb)

0.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with 8451-07221 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8451-07221?
Check Price and Availability of 8451-07221, 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 8451-07221 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8451-07221
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8451-07221
  • 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 8451-07221 available by request