L414-0565 Screening compound: N-(4-chlorophenyl)-2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}acetamide

L414-0565 Screening compound: N-(4-chlorophenyl)-2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}acetamide
L414-0565 Screening compound: N-(4-chlorophenyl)-2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L414-0565
N-(4-chlorophenyl)-2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}acetamide

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

L414-0565

Molecular Formula

C20H18ClN3O2S (C20 H18 ClN3 O2 S)

Compound Name

N-(4-chlorophenyl)-2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}acetamide

IUPAC name

N-(4-chlorophenyl)-2-{[1-(34-dimethylphenyl)-6-oxo-16-dihydropyridazin-3-yl]sulfanyl}acetamide

SMILES

Cc(cc1)c(C)cc1N(C(C=C1)=O)N=C1SCC(Nc(cc1)ccc1Cl)=O

InChI

InChI=1S/C20H18ClN3O2S/c1-13-3-8-17(11-14(13)2)24-20(26)10-9-19(23-24)27-12-18(25)22-16-6-4-15(21)5-7-16/h3-11H,12H2,1-2H3,(H,22,25)

InChI Key

JBWFHTLZCCKRNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15126494

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.9

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.778

Distribution Coefficient, logD

4.778

Water Solubility, LogSw

-4.87

Polar Surface Area

50.697

Acid Dissociation Constant (pKa)

11.07

Base Dissociation Constant (pKb)

0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with L414-0565 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L414-0565?
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What is the minimum amount of L414-0565 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L414-0565
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L414-0565
  • 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 L414-0565 available by request