C519-1529 Screening compound: N-(2,2-dimethoxyethyl)-1-ethyl-6-(morpholine-4-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide

C519-1529 Screening compound: N-(2,2-dimethoxyethyl)-1-ethyl-6-(morpholine-4-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
C519-1529 Screening compound: N-(2,2-dimethoxyethyl)-1-ethyl-6-(morpholine-4-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C519-1529
N-(2,2-dimethoxyethyl)-1-ethyl-6-(morpholine-4-sulfonyl)-4-oxo-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

C519-1529

Molecular Formula

C20H27N3O7S (C20 H27 N3 O7 S)

Compound Name

N-(2,2-dimethoxyethyl)-1-ethyl-6-(morpholine-4-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide

IUPAC name

N-(22-dimethoxyethyl)-1-ethyl-6-(morpholine-4-sulfonyl)-4-oxo-14-dihydroquinoline-3-carboxamide

SMILES

CCN(C=C1C(NCC(OC)OC)=O)c(ccc(S(N2CCOCC2)(=O)=O)c2)c2C1=O

InChI

InChI=1S/C20H27N3O7S/c1-4-22-13-16(20(25)21-12-18(28-2)29-3)19(24)15-11-14(5-6-17(15)22)31(26,27)23-7-9-30-10-8-23/h5-6,11,13,18H,4,7-10,12H2,1-3H3,(H,21,25)

InChI Key

PDIUKLISBGROHJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14764769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.52

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.054

Distribution Coefficient, logD

-0.054

Water Solubility, LogSw

-2.67

Polar Surface Area

95.357

Acid Dissociation Constant (pKa)

11.67

Base Dissociation Constant (pKb)

-1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

C519-1529 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C519-1529 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C519-1529?
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What is the minimum amount of C519-1529 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C519-1529
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C519-1529
  • 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 C519-1529 available by request