F207-0054 Screening compound: methyl 3-(3,5-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

F207-0054 Screening compound: methyl 3-(3,5-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
F207-0054 Screening compound: methyl 3-(3,5-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F207-0054
methyl 3-(3,5-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

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

F207-0054

Molecular Formula

C18H16N2O5S (C18 H16 N2 O5 S)

Compound Name

methyl 3-(3,5-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

IUPAC name

methyl 3-(35-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1234-tetrahydroquinazoline-7-carboxylate

SMILES

COC(c(cc1)cc(NC(N2c3cc(OC)cc(OC)c3)=S)c1C2=O)=O

InChI

InChI=1S/C18H16N2O5S/c1-23-12-7-11(8-13(9-12)24-2)20-16(21)14-5-4-10(17(22)25-3)6-15(14)19-18(20)26/h4-9H,1-3H3,(H,19,26)

InChI Key

KEPLSBQPNVDPHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14944548

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.357

Distribution Coefficient, logD

3.352

Water Solubility, LogSw

-3.72

Polar Surface Area

62.968

Acid Dissociation Constant (pKa)

9.31

Base Dissociation Constant (pKb)

-9.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

F207-0054 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with F207-0054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F207-0054?
Check Price and Availability of F207-0054, 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 F207-0054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F207-0054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F207-0054
  • 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 F207-0054 available by request