G620-0057 Screening compound: N-{3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl}-2,4-difluorobenzene-1-sulfonamide

G620-0057 Screening compound: N-{3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl}-2,4-difluorobenzene-1-sulfonamide
G620-0057 Screening compound: N-{3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl}-2,4-difluorobenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G620-0057
N-{3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl}-2,4-difluorobenzene-1-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

G620-0057

Molecular Formula

C22H22F2N4O2S (C22 H22 F2 N4 O2 S)

Compound Name

N-{3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl}-2,4-difluorobenzene-1-sulfonamide

IUPAC name

N-{3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl}-24-difluorobenzene-1-sulfonamide

SMILES

O=S(c(ccc(F)c1)c1F)(Nc1cc(-c(cc2)nnc2N2CCCCCC2)ccc1)=O

InChI

InChI=1S/C22H22F2N4O2S/c23-17-8-10-21(19(24)15-17)31(29,30)27-18-7-5-6-16(14-18)20-9-11-22(26-25-20)28-12-3-1-2-4-13-28/h5-11,14-15,27H,1-4,12-13H2

InChI Key

VRLIYCIFSMMWSS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14048780

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.078

Distribution Coefficient, logD

5.065

Water Solubility, LogSw

-5.14

Polar Surface Area

65.606

Acid Dissociation Constant (pKa)

8.98

Base Dissociation Constant (pKb)

5.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

G620-0057 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system

References: we are preparing a list of scientific research reports with G620-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G620-0057?
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What is the minimum amount of G620-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G620-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G620-0057
  • 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 G620-0057 available by request