L486-0378 Screening compound: 3-[1-(3-chloro-4-fluorobenzenesulfonyl)piperidin-4-yl]-7-fluoro-3,4-dihydroquinazolin-4-one

L486-0378 Screening compound: 3-[1-(3-chloro-4-fluorobenzenesulfonyl)piperidin-4-yl]-7-fluoro-3,4-dihydroquinazolin-4-one
L486-0378 Screening compound: 3-[1-(3-chloro-4-fluorobenzenesulfonyl)piperidin-4-yl]-7-fluoro-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L486-0378
3-[1-(3-chloro-4-fluorobenzenesulfonyl)piperidin-4-yl]-7-fluoro-3,4-dihydroquinazolin-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

L486-0378

Molecular Formula

C19H16ClF2N3O3S (C19 H16 ClF2 N3 O3 S)

Compound Name

3-[1-(3-chloro-4-fluorobenzenesulfonyl)piperidin-4-yl]-7-fluoro-3,4-dihydroquinazolin-4-one

IUPAC name

3-[1-(3-chloro-4-fluorobenzenesulfonyl)piperidin-4-yl]-7-fluoro-34-dihydroquinazolin-4-one

SMILES

O=C1N(C(CC2)CCN2S(c(cc2)cc(Cl)c2F)(=O)=O)C=Nc2c1ccc(F)c2

InChI

InChI=1S/C19H16ClF2N3O3S/c20-16-10-14(2-4-17(16)22)29(27,28)24-7-5-13(6-8-24)25-11-23-18-9-12(21)1-3-15(18)19(25)26/h1-4,9-11,13H,5-8H2

InChI Key

VOOKQGVEKFAMHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27457072

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.87

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.004

Distribution Coefficient, logD

3.004

Water Solubility, LogSw

-3.58

Polar Surface Area

57.245

Acid Dissociation Constant (pKa)

27.88

Base Dissociation Constant (pKb)

1.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

L486-0378 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with L486-0378 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L486-0378?
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What is the minimum amount of L486-0378 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L486-0378
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L486-0378
  • 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 L486-0378 available by request