C519-1079 Screening compound: 1-ethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N,N-dimethyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide

C519-1079 Screening compound: 1-ethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N,N-dimethyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide
C519-1079 Screening compound: 1-ethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N,N-dimethyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C519-1079
1-ethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N,N-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

C519-1079

Molecular Formula

C24H27FN4O4S (C24 H27 FN4 O4 S)

Compound Name

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

IUPAC name

1-ethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-NN-dimethyl-4-oxo-14-dihydroquinoline-6-sulfonamide

SMILES

CCN(C=C1C(N(CC2)CCN2c(cc2)ccc2F)=O)c(ccc(S(N(C)C)(=O)=O)c2)c2C1=O

InChI

InChI=1S/C24H27FN4O4S/c1-4-27-16-21(23(30)20-15-19(9-10-22(20)27)34(32,33)26(2)3)24(31)29-13-11-28(12-14-29)18-7-5-17(25)6-8-18/h5-10,15-16H,4,11-14H2,1-3H3

InChI Key

KXENNMYROJJPDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14764623

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.57

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

2.317

Distribution Coefficient, logD

2.317

Water Solubility, LogSw

-3.00

Polar Surface Area

69.131

Acid Dissociation Constant (pKa)

28.16

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

C519-1079 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 C519-1079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C519-1079?
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What is the minimum amount of C519-1079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C519-1079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C519-1079
  • 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 C519-1079 available by request