C201-0476 Screening compound: N-(3-fluoro-4-methylphenyl)-1-{6-[(4-methylphenyl)sulfanyl]pyridazin-3-yl}piperidine-4-carboxamide

C201-0476 Screening compound: N-(3-fluoro-4-methylphenyl)-1-{6-[(4-methylphenyl)sulfanyl]pyridazin-3-yl}piperidine-4-carboxamide
C201-0476 Screening compound: N-(3-fluoro-4-methylphenyl)-1-{6-[(4-methylphenyl)sulfanyl]pyridazin-3-yl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0476
N-(3-fluoro-4-methylphenyl)-1-{6-[(4-methylphenyl)sulfanyl]pyridazin-3-yl}piperidine-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

C201-0476

Molecular Formula

C24H25FN4OS (C24 H25 FN4 OS)

Compound Name

N-(3-fluoro-4-methylphenyl)-1-{6-[(4-methylphenyl)sulfanyl]pyridazin-3-yl}piperidine-4-carboxamide

IUPAC name

N-(3-fluoro-4-methylphenyl)-1-{6-[(4-methylphenyl)sulfanyl]pyridazin-3-yl}piperidine-4-carboxamide

SMILES

Cc(cc1)ccc1Sc(cc1)nnc1N(CC1)CCC1C(Nc1cc(F)c(C)cc1)=O

InChI

InChI=1S/C24H25FN4OS/c1-16-3-7-20(8-4-16)31-23-10-9-22(27-28-23)29-13-11-18(12-14-29)24(30)26-19-6-5-17(2)21(25)15-19/h3-10,15,18H,11-14H2,1-2H3,(H,26,30)

InChI Key

DPIXUUPCTACMEV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729426

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.577

Distribution Coefficient, logD

5.576

Water Solubility, LogSw

-5.31

Polar Surface Area

47.078

Acid Dissociation Constant (pKa)

10.08

Base Dissociation Constant (pKb)

3.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

C201-0476 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C201-0476 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0476?
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What is the minimum amount of C201-0476 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0476
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0476
  • 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 C201-0476 available by request