P048-2137 Screening compound: tert-butyl 2-[N-(3,5-difluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate

P048-2137 Screening compound: tert-butyl 2-[N-(3,5-difluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate
P048-2137 Screening compound: tert-butyl 2-[N-(3,5-difluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound P048-2137
tert-butyl 2-[N-(3,5-difluorophenyl)[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

P048-2137

Molecular Formula

C18H18F2N4O4S (C18 H18 F2 N4 O4 S)

Compound Name

tert-butyl 2-[N-(3,5-difluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamido]acetate

IUPAC name

tert-butyl 2-[N-(35-difluorophenyl)[124]triazolo[43-a]pyridine-6-sulfonamido]acetate

SMILES

CC(C)(C)OC(CN(c1cc(F)cc(F)c1)S(c(cc1)cn2c1nnc2)(=O)=O)=O

InChI

InChI=1S/C18H18F2N4O4S/c1-18(2,3)28-17(25)10-24(14-7-12(19)6-13(20)8-14)29(26,27)15-4-5-16-22-21-11-23(16)9-15/h4-9,11H,10H2,1-3H3

InChI Key

RMEUIDHXSKXGMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27560891

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.43

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

2.744

Distribution Coefficient, logD

2.744

Water Solubility, LogSw

-3.14

Polar Surface Area

74.278

Acid Dissociation Constant (pKa)

21.19

Base Dissociation Constant (pKb)

1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

References: we are preparing a list of scientific research reports with P048-2137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P048-2137?
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What is the minimum amount of P048-2137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P048-2137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P048-2137
  • 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 P048-2137 available by request