C385-0714 Screening compound: N-butyl-N-ethyl-6-{[3-(methylsulfanyl)phenyl]sulfamoyl}-4-oxo-1,4-dihydroquinoline-3-carboxamide

C385-0714 Screening compound: N-butyl-N-ethyl-6-{[3-(methylsulfanyl)phenyl]sulfamoyl}-4-oxo-1,4-dihydroquinoline-3-carboxamide
C385-0714 Screening compound: N-butyl-N-ethyl-6-{[3-(methylsulfanyl)phenyl]sulfamoyl}-4-oxo-1,4-dihydroquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C385-0714
N-butyl-N-ethyl-6-{[3-(methylsulfanyl)phenyl]sulfamoyl}-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

C385-0714

Molecular Formula

C23H27N3O4S2 (C23 H27 N3 O4 S2)

Compound Name

N-butyl-N-ethyl-6-{[3-(methylsulfanyl)phenyl]sulfamoyl}-4-oxo-1,4-dihydroquinoline-3-carboxamide

IUPAC name

N-butyl-N-ethyl-6-{[3-(methylsulfanyl)phenyl]sulfamoyl}-4-oxo-14-dihydroquinoline-3-carboxamide

SMILES

CCCCN(CC)C(C1=CNc(ccc(S(Nc2cc(SC)ccc2)(=O)=O)c2)c2C1=O)=O

InChI

InChI=1S/C23H27N3O4S2/c1-4-6-12-26(5-2)23(28)20-15-24-21-11-10-18(14-19(21)22(20)27)32(29,30)25-16-8-7-9-17(13-16)31-3/h7-11,13-15,25H,4-6,12H2,1-3H3,(H,24,27)

InChI Key

LVCOKDDANWPDIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14755150

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.62

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.169

Distribution Coefficient, logD

2.598

Water Solubility, LogSw

-4.00

Polar Surface Area

81.193

Acid Dissociation Constant (pKa)

5.84

Base Dissociation Constant (pKb)

3.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with C385-0714 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C385-0714?
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What is the minimum amount of C385-0714 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C385-0714
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C385-0714
  • 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 C385-0714 available by request