P048-1894 Screening compound: methyl 2-[N-(4-fluorophenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate

P048-1894 Screening compound: methyl 2-[N-(4-fluorophenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate
P048-1894 Screening compound: methyl 2-[N-(4-fluorophenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound P048-1894
methyl 2-[N-(4-fluorophenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate

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

P048-1894

Molecular Formula

C16H15FN4O4S (C16 H15 FN4 O4 S)

Compound Name

methyl 2-[N-(4-fluorophenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate

IUPAC name

methyl 2-[N-(4-fluorophenyl)3-methyl-[124]triazolo[43-a]pyridine-6-sulfonamido]acetate

SMILES

Cc1nnc(cc2)n1cc2S(N(CC(OC)=O)c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C16H15FN4O4S/c1-11-18-19-15-8-7-14(9-20(11)15)26(23,24)21(10-16(22)25-2)13-5-3-12(17)4-6-13/h3-9H,10H2,1-2H3

InChI Key

BSIOSQCLMMGCCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27560863

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.38

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.930

Distribution Coefficient, logD

0.930

Water Solubility, LogSw

-2.26

Polar Surface Area

74.923

Acid Dissociation Constant (pKa)

19.53

Base Dissociation Constant (pKb)

1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

P048-1894 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P048-1894 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P048-1894?
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What is the minimum amount of P048-1894 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P048-1894
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P048-1894
  • 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 P048-1894 available by request