P666-1563 Screening compound: 2-ethyl-N-(3-fluoro-4-methylphenyl)-4-methyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide

P666-1563 Screening compound: 2-ethyl-N-(3-fluoro-4-methylphenyl)-4-methyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide
P666-1563 Screening compound: 2-ethyl-N-(3-fluoro-4-methylphenyl)-4-methyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P666-1563
2-ethyl-N-(3-fluoro-4-methylphenyl)-4-methyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-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

P666-1563

Molecular Formula

C16H17FN4O3S (C16 H17 FN4 O3 S)

Compound Name

2-ethyl-N-(3-fluoro-4-methylphenyl)-4-methyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide

IUPAC name

2-ethyl-N-(3-fluoro-4-methylphenyl)-4-methyl-1-oxo-1H2H-pyrrolo[12-d][124]triazine-7-sulfonamide

SMILES

CCN(C1=O)N=C(C)n2c1cc(S(Nc1cc(F)c(C)cc1)(=O)=O)c2

InChI

InChI=1S/C16H17FN4O3S/c1-4-21-16(22)15-8-13(9-20(15)11(3)18-21)25(23,24)19-12-6-5-10(2)14(17)7-12/h5-9,19H,4H2,1-3H3

InChI Key

DWXONXNJPSCSPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27610515

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.486

Distribution Coefficient, logD

2.366

Water Solubility, LogSw

-2.83

Polar Surface Area

70.838

Acid Dissociation Constant (pKa)

7.90

Base Dissociation Constant (pKb)

4.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with P666-1563 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P666-1563?
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What is the minimum amount of P666-1563 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P666-1563
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P666-1563
  • 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 P666-1563 available by request