P666-2135 Screening compound: 4-ethyl-N-(4-fluorophenyl)-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide

P666-2135 Screening compound: 4-ethyl-N-(4-fluorophenyl)-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide
P666-2135 Screening compound: 4-ethyl-N-(4-fluorophenyl)-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P666-2135
4-ethyl-N-(4-fluorophenyl)-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

P666-2135

Molecular Formula

C14H13FN4O3S (C14 H13 FN4 O3 S)

Compound Name

4-ethyl-N-(4-fluorophenyl)-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide

IUPAC name

4-ethyl-N-(4-fluorophenyl)-1-oxo-1H2H-pyrrolo[12-d][124]triazine-7-sulfonamide

SMILES

CCC(n1c2cc(S(Nc(cc3)ccc3F)(=O)=O)c1)=NNC2=O

InChI

InChI=1S/C14H13FN4O3S/c1-2-13-16-17-14(20)12-7-11(8-19(12)13)23(21,22)18-10-5-3-9(15)4-6-10/h3-8,18H,2H2,1H3,(H,17,20)

InChI Key

DHKQMKYQJMUYLR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27610555

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.774

Distribution Coefficient, logD

1.695

Water Solubility, LogSw

-2.69

Polar Surface Area

81.096

Acid Dissociation Constant (pKa)

8.10

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

P666-2135 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with P666-2135 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P666-2135?
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What is the minimum amount of P666-2135 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P666-2135
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P666-2135
  • 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 P666-2135 available by request