F814-1412 Screening compound: 2-[(6-{[(4-chlorophenyl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide

F814-1412 Screening compound: 2-[(6-{[(4-chlorophenyl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide
F814-1412 Screening compound: 2-[(6-{[(4-chlorophenyl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F814-1412
2-[(6-{[(4-chlorophenyl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)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

F814-1412

Molecular Formula

C21H21ClN4OS (C21 H21 ClN4 OS)

Compound Name

2-[(6-{[(4-chlorophenyl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide

IUPAC name

2-[(6-{[(4-chlorophenyl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-(24-dimethylphenyl)acetamide

SMILES

Cc(cc1)cc(C)c1NC(CSc(cc1)nnc1NCc(cc1)ccc1Cl)=O

InChI

InChI=1S/C21H21ClN4OS/c1-14-3-8-18(15(2)11-14)24-20(27)13-28-21-10-9-19(25-26-21)23-12-16-4-6-17(22)7-5-16/h3-11H,12-13H2,1-2H3,(H,23,25)(H,24,27)

InChI Key

QQPHRZUEMWGMNH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27193998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.94

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.439

Distribution Coefficient, logD

4.439

Water Solubility, LogSw

-4.59

Polar Surface Area

54.324

Acid Dissociation Constant (pKa)

12.36

Base Dissociation Constant (pKb)

2.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with F814-1412 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F814-1412?
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What is the minimum amount of F814-1412 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F814-1412
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F814-1412
  • 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 F814-1412 available by request