P048-1753 Screening compound: tert-butyl 2-[N-(3-fluorophenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate

P048-1753 Screening compound: tert-butyl 2-[N-(3-fluorophenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate
P048-1753 Screening compound: tert-butyl 2-[N-(3-fluorophenyl)3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound P048-1753
tert-butyl 2-[N-(3-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

P048-1753

Molecular Formula

C19H21FN4O4S (C19 H21 FN4 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CC(C)(C)OC(CN(c1cc(F)ccc1)S(c(cc1)cn2c1nnc2C)(=O)=O)=O

InChI

InChI=1S/C19H21FN4O4S/c1-13-21-22-17-9-8-16(11-23(13)17)29(26,27)24(12-18(25)28-19(2,3)4)15-7-5-6-14(20)10-15/h5-11H,12H2,1-4H3

InChI Key

MLNUXERBNYKZPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27560845

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.371

Distribution Coefficient, logD

2.371

Water Solubility, LogSw

-2.71

Polar Surface Area

73.612

Acid Dissociation Constant (pKa)

21.42

Base Dissociation Constant (pKb)

1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with P048-1753 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P048-1753?
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What is the minimum amount of P048-1753 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P048-1753
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P048-1753
  • 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 P048-1753 available by request