F387-0159 Screening compound: N~1~-[1-(3-{[2-ethyl-4-oxo-3(4H)-quinazolinyl]methyl}-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-4-methyl-1-benzenesulfonamide

F387-0159 Screening compound: N~1~-[1-(3-{[2-ethyl-4-oxo-3(4H)-quinazolinyl]methyl}-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-4-methyl-1-benzenesulfonamide
F387-0159 Screening compound: N~1~-[1-(3-{[2-ethyl-4-oxo-3(4H)-quinazolinyl]methyl}-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-4-methyl-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F387-0159
N~1~-[1-(3-{[2-ethyl-4-oxo-3(4H)-quinazolinyl]methyl}-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-4-methyl-1-benzenesulfonamide

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

F387-0159

Molecular Formula

C24H27N5O4S (C24 H27 N5 O4 S)

Compound Name

N~1~-[1-(3-{[2-ethyl-4-oxo-3(4H)-quinazolinyl]methyl}-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-4-methyl-1-benzenesulfonamide

IUPAC name

N-(1-{3-[(2-ethyl-4-oxo-34-dihydroquinazolin-3-yl)methyl]-124-oxadiazol-5-yl}-2-methylpropyl)-4-methylbenzene-1-sulfonamide

SMILES

CCC(N1Cc2noc(C(C(C)C)NS(c3ccc(C)cc3)(=O)=O)n2)=Nc(cccc2)c2C1=O

InChI

InChI=1S/C24H27N5O4S/c1-5-21-25-19-9-7-6-8-18(19)24(30)29(21)14-20-26-23(33-27-20)22(15(2)3)28-34(31,32)17-12-10-16(4)11-13-17/h6-13,15,22,28H,5,14H2,1-4H3/t22-/m0/s1

InChI Key

VESGEWZOTDWYPE-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD27122086

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.58

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.837

Distribution Coefficient, logD

3.821

Water Solubility, LogSw

-3.95

Polar Surface Area

99.740

Acid Dissociation Constant (pKa)

8.83

Base Dissociation Constant (pKb)

3.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.33

F387-0159 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 F387-0159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F387-0159?
Check Price and Availability of F387-0159, 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 F387-0159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F387-0159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F387-0159
  • 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 F387-0159 available by request