F080-1284 Screening compound: N-(2-bromo-4-methylphenyl)-6-chloro-3-(thiomorpholine-4-carbonyl)quinolin-4-amine

F080-1284 Screening compound: N-(2-bromo-4-methylphenyl)-6-chloro-3-(thiomorpholine-4-carbonyl)quinolin-4-amine
F080-1284 Screening compound: N-(2-bromo-4-methylphenyl)-6-chloro-3-(thiomorpholine-4-carbonyl)quinolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound F080-1284
N-(2-bromo-4-methylphenyl)-6-chloro-3-(thiomorpholine-4-carbonyl)quinolin-4-amine

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

F080-1284

Molecular Formula

C21H19BrClN3OS (C21 H19 BrClN3 OS)

Compound Name

N-(2-bromo-4-methylphenyl)-6-chloro-3-(thiomorpholine-4-carbonyl)quinolin-4-amine

IUPAC name

N-(2-bromo-4-methylphenyl)-6-chloro-3-(thiomorpholine-4-carbonyl)quinolin-4-amine

SMILES

Cc(cc1)cc(Br)c1Nc(c1cc(Cl)ccc1nc1)c1C(N1CCSCC1)=O

InChI

InChI=1S/C21H19BrClN3OS/c1-13-2-4-19(17(22)10-13)25-20-15-11-14(23)3-5-18(15)24-12-16(20)21(27)26-6-8-28-9-7-26/h2-5,10-12H,6-9H2,1H3,(H,24,25)

InChI Key

VRMRJTQEWJZIHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27099974

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.82

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.270

Distribution Coefficient, logD

5.265

Water Solubility, LogSw

-5.69

Polar Surface Area

32.558

Acid Dissociation Constant (pKa)

14.88

Base Dissociation Constant (pKb)

5.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

F080-1284 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F080-1284 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F080-1284?
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What is the minimum amount of F080-1284 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F080-1284
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F080-1284
  • 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 F080-1284 available by request