L414-1894 Screening compound: N-(2,4-dimethylphenyl)-2-{[1-(4-methoxyphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}acetamide

L414-1894 Screening compound: N-(2,4-dimethylphenyl)-2-{[1-(4-methoxyphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}acetamide
L414-1894 Screening compound: N-(2,4-dimethylphenyl)-2-{[1-(4-methoxyphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L414-1894
N-(2,4-dimethylphenyl)-2-{[1-(4-methoxyphenyl)-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

L414-1894

Molecular Formula

C21H21N3O3S (C21 H21 N3 O3 S)

Compound Name

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

IUPAC name

N-(24-dimethylphenyl)-2-{[1-(4-methoxyphenyl)-6-oxo-16-dihydropyridazin-3-yl]sulfanyl}acetamide

SMILES

Cc(cc1)cc(C)c1NC(CSC(C=C1)=NN(c(cc2)ccc2OC)C1=O)=O

InChI

InChI=1S/C21H21N3O3S/c1-14-4-9-18(15(2)12-14)22-19(25)13-28-20-10-11-21(26)24(23-20)16-5-7-17(27-3)8-6-16/h4-12H,13H2,1-3H3,(H,22,25)

InChI Key

NURGSCXNJJPCQZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15126716

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.511

Distribution Coefficient, logD

3.511

Water Solubility, LogSw

-3.76

Polar Surface Area

57.543

Acid Dissociation Constant (pKa)

12.50

Base Dissociation Constant (pKb)

0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

L414-1894 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with L414-1894 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L414-1894?
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What is the minimum amount of L414-1894 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L414-1894
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L414-1894
  • 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 L414-1894 available by request