F019-2507 Screening compound: methyl 3-{2-[(4-methylphenyl)sulfanyl]ethyl}-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

F019-2507 Screening compound: methyl 3-{2-[(4-methylphenyl)sulfanyl]ethyl}-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
F019-2507 Screening compound: methyl 3-{2-[(4-methylphenyl)sulfanyl]ethyl}-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F019-2507
methyl 3-{2-[(4-methylphenyl)sulfanyl]ethyl}-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

F019-2507

Molecular Formula

C19H18N2O3S2 (C19 H18 N2 O3 S2)

Compound Name

methyl 3-{2-[(4-methylphenyl)sulfanyl]ethyl}-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

IUPAC name

methyl 3-{2-[(4-methylphenyl)sulfanyl]ethyl}-4-oxo-2-sulfanylidene-1234-tetrahydroquinazoline-7-carboxylate

SMILES

Cc(cc1)ccc1SCCN(C(c(ccc(C(OC)=O)c1)c1N1)=O)C1=S

InChI

InChI=1S/C19H18N2O3S2/c1-12-3-6-14(7-4-12)26-10-9-21-17(22)15-8-5-13(18(23)24-2)11-16(15)20-19(21)25/h3-8,11H,9-10H2,1-2H3,(H,20,25)

InChI Key

FEHPSSWIIDHNSU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06136619

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.363

Distribution Coefficient, logD

4.359

Water Solubility, LogSw

-4.18

Polar Surface Area

48.470

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

-9.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

F019-2507 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with F019-2507 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F019-2507?
Check Price and Availability of F019-2507, 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 F019-2507 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F019-2507
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F019-2507
  • 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 F019-2507 available by request