C519-0655 Screening compound: N-cyclohexyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N,1-dimethyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide

C519-0655 Screening compound: N-cyclohexyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N,1-dimethyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide
C519-0655 Screening compound: N-cyclohexyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N,1-dimethyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C519-0655
N-cyclohexyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N,1-dimethyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide

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

C519-0655

Molecular Formula

C28H33FN4O4S (C28 H33 FN4 O4 S)

Compound Name

N-cyclohexyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N,1-dimethyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide

IUPAC name

N-cyclohexyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N1-dimethyl-4-oxo-14-dihydroquinoline-6-sulfonamide

SMILES

CN(C1CCCCC1)S(c(cc1)cc2c1N(C)C=C(C(N(CC1)CCN1c(cc1)ccc1F)=O)C2=O)(=O)=O

InChI

InChI=1S/C28H33FN4O4S/c1-30-19-25(28(35)33-16-14-32(15-17-33)22-10-8-20(29)9-11-22)27(34)24-18-23(12-13-26(24)30)38(36,37)31(2)21-6-4-3-5-7-21/h8-13,18-19,21H,3-7,14-17H2,1-2H3

InChI Key

WATDVWQLRPGCKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14764501

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

540.66

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.485

Distribution Coefficient, logD

3.485

Water Solubility, LogSw

-4.00

Polar Surface Area

68.112

Acid Dissociation Constant (pKa)

26.77

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

C519-0655 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C519-0655 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C519-0655?
Check Price and Availability of C519-0655, 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 C519-0655 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C519-0655
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C519-0655
  • 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 C519-0655 available by request