C072-0272 Screening compound: N-cycloheptyl-2-[(4-fluorophenyl)sulfanyl]quinoline-4-carboxamide

C072-0272 Screening compound: N-cycloheptyl-2-[(4-fluorophenyl)sulfanyl]quinoline-4-carboxamide
C072-0272 Screening compound: N-cycloheptyl-2-[(4-fluorophenyl)sulfanyl]quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C072-0272
N-cycloheptyl-2-[(4-fluorophenyl)sulfanyl]quinoline-4-carboxamide

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

C072-0272

Molecular Formula

C23H23FN2OS (C23 H23 FN2 OS)

Compound Name

N-cycloheptyl-2-[(4-fluorophenyl)sulfanyl]quinoline-4-carboxamide

IUPAC name

N-cycloheptyl-2-[(4-fluorophenyl)sulfanyl]quinoline-4-carboxamide

SMILES

O=C(c1cc(Sc(cc2)ccc2F)nc2ccccc12)NC1CCCCCC1

InChI

InChI=1S/C23H23FN2OS/c24-16-11-13-18(14-12-16)28-22-15-20(19-9-5-6-10-21(19)26-22)23(27)25-17-7-3-1-2-4-8-17/h5-6,9-15,17H,1-4,7-8H2,(H,25,27)

InChI Key

QFGPZMSVRVFGAE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14716681

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.737

Distribution Coefficient, logD

6.737

Water Solubility, LogSw

-6.29

Polar Surface Area

32.128

Acid Dissociation Constant (pKa)

15.17

Base Dissociation Constant (pKb)

3.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with C072-0272 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C072-0272?
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What is the minimum amount of C072-0272 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C072-0272
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C072-0272
  • 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 C072-0272 available by request