C519-1364 Screening compound: 1-ethyl-N-{2-[ethyl(phenyl)amino]ethyl}-4-oxo-6-(pyrrolidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide

C519-1364 Screening compound: 1-ethyl-N-{2-[ethyl(phenyl)amino]ethyl}-4-oxo-6-(pyrrolidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide
C519-1364 Screening compound: 1-ethyl-N-{2-[ethyl(phenyl)amino]ethyl}-4-oxo-6-(pyrrolidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C519-1364
1-ethyl-N-{2-[ethyl(phenyl)amino]ethyl}-4-oxo-6-(pyrrolidine-1-sulfonyl)-1,4-dihydroquinoline-3-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

C519-1364

Molecular Formula

C26H32N4O4S (C26 H32 N4 O4 S)

Compound Name

1-ethyl-N-{2-[ethyl(phenyl)amino]ethyl}-4-oxo-6-(pyrrolidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide

IUPAC name

1-ethyl-N-{2-[ethyl(phenyl)amino]ethyl}-4-oxo-6-(pyrrolidine-1-sulfonyl)-14-dihydroquinoline-3-carboxamide

SMILES

CCN(CCNC(C1=CN(CC)c(ccc(S(N2CCCC2)(=O)=O)c2)c2C1=O)=O)c1ccccc1

InChI

InChI=1S/C26H32N4O4S/c1-3-28(20-10-6-5-7-11-20)17-14-27-26(32)23-19-29(4-2)24-13-12-21(18-22(24)25(23)31)35(33,34)30-15-8-9-16-30/h5-7,10-13,18-19H,3-4,8-9,14-17H2,1-2H3,(H,27,32)

InChI Key

XCVHTHNHRRBASI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14764704

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.953

Distribution Coefficient, logD

2.953

Water Solubility, LogSw

-3.78

Polar Surface Area

74.880

Acid Dissociation Constant (pKa)

12.59

Base Dissociation Constant (pKb)

4.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

C519-1364 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C519-1364 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C519-1364?
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What is the minimum amount of C519-1364 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C519-1364
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C519-1364
  • 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 C519-1364 available by request