F946-0487 Screening compound: N-cyclohexyl-5-[1-(3,5-dimethyl-1,2-oxazol-4-yl)-6-oxo-1,6-dihydropyridazin-3-yl]-2-methoxy-N-methylbenzene-1-sulfonamide

F946-0487 Screening compound: N-cyclohexyl-5-[1-(3,5-dimethyl-1,2-oxazol-4-yl)-6-oxo-1,6-dihydropyridazin-3-yl]-2-methoxy-N-methylbenzene-1-sulfonamide
F946-0487 Screening compound: N-cyclohexyl-5-[1-(3,5-dimethyl-1,2-oxazol-4-yl)-6-oxo-1,6-dihydropyridazin-3-yl]-2-methoxy-N-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F946-0487
N-cyclohexyl-5-[1-(3,5-dimethyl-1,2-oxazol-4-yl)-6-oxo-1,6-dihydropyridazin-3-yl]-2-methoxy-N-methylbenzene-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

F946-0487

Molecular Formula

C23H28N4O5S (C23 H28 N4 O5 S)

Compound Name

N-cyclohexyl-5-[1-(3,5-dimethyl-1,2-oxazol-4-yl)-6-oxo-1,6-dihydropyridazin-3-yl]-2-methoxy-N-methylbenzene-1-sulfonamide

IUPAC name

N-cyclohexyl-5-[1-(35-dimethyl-12-oxazol-4-yl)-6-oxo-16-dihydropyridazin-3-yl]-2-methoxy-N-methylbenzene-1-sulfonamide

SMILES

Cc1noc(C)c1N(C(C=C1)=O)N=C1c(cc1)cc(S(N(C)C2CCCCC2)(=O)=O)c1OC

InChI

InChI=1S/C23H28N4O5S/c1-15-23(16(2)32-25-15)27-22(28)13-11-19(24-27)17-10-12-20(31-4)21(14-17)33(29,30)26(3)18-8-6-5-7-9-18/h10-14,18H,5-9H2,1-4H3

InChI Key

UKSBONFUAGLSGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27205551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.57

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.622

Distribution Coefficient, logD

3.622

Water Solubility, LogSw

-4.01

Polar Surface Area

88.849

Acid Dissociation Constant (pKa)

26.77

Base Dissociation Constant (pKb)

0.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

F946-0487 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F946-0487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F946-0487?
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What is the minimum amount of F946-0487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F946-0487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F946-0487
  • 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 F946-0487 available by request