C208-0047 Screening compound: 6-(azepane-1-sulfonyl)-N-cyclopropyl-2-oxo-1,2-dihydroquinoline-4-carboxamide

C208-0047 Screening compound: 6-(azepane-1-sulfonyl)-N-cyclopropyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
C208-0047 Screening compound: 6-(azepane-1-sulfonyl)-N-cyclopropyl-2-oxo-1,2-dihydroquinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C208-0047
6-(azepane-1-sulfonyl)-N-cyclopropyl-2-oxo-1,2-dihydroquinoline-4-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

C208-0047

Molecular Formula

C19H23N3O4S (C19 H23 N3 O4 S)

Compound Name

6-(azepane-1-sulfonyl)-N-cyclopropyl-2-oxo-1,2-dihydroquinoline-4-carboxamide

IUPAC name

6-(azepane-1-sulfonyl)-N-cyclopropyl-2-oxo-12-dihydroquinoline-4-carboxamide

SMILES

O=C(C(c(cc(cc1)S(N2CCCCCC2)(=O)=O)c1N1)=CC1=O)NC1CC1

InChI

InChI=1S/C19H23N3O4S/c23-18-12-16(19(24)20-13-5-6-13)15-11-14(7-8-17(15)21-18)27(25,26)22-9-3-1-2-4-10-22/h7-8,11-13H,1-6,9-10H2,(H,20,24)(H,21,23)

InChI Key

KQBUXQWKPAFFOS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05029438

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.230

Distribution Coefficient, logD

2.188

Water Solubility, LogSw

-3.15

Polar Surface Area

81.571

Acid Dissociation Constant (pKa)

8.39

Base Dissociation Constant (pKb)

-0.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

C208-0047 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with C208-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C208-0047?
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What is the minimum amount of C208-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C208-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C208-0047
  • 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 C208-0047 available by request