E955-0743 Screening compound: tert-butyl 4-[1-(2,4-difluorophenyl)-4-[(2-ethylphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate

E955-0743 Screening compound: tert-butyl 4-[1-(2,4-difluorophenyl)-4-[(2-ethylphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate
E955-0743 Screening compound: tert-butyl 4-[1-(2,4-difluorophenyl)-4-[(2-ethylphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E955-0743
tert-butyl 4-[1-(2,4-difluorophenyl)-4-[(2-ethylphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate

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

E955-0743

Molecular Formula

C28H32F2N4O3 (C28 H32 F2 N4 O3)

Compound Name

tert-butyl 4-[1-(2,4-difluorophenyl)-4-[(2-ethylphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate

IUPAC name

tert-butyl 4-[1-(24-difluorophenyl)-4-[(2-ethylphenyl)carbamoyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate

SMILES

CCc(cccc1)c1NC(c1c(C(CC2)CCN2C(OC(C)(C)C)=O)n(-c(ccc(F)c2)c2F)nc1)=O

InChI

InChI=1S/C28H32F2N4O3/c1-5-18-8-6-7-9-23(18)32-26(35)21-17-31-34(24-11-10-20(29)16-22(24)30)25(21)19-12-14-33(15-13-19)27(36)37-28(2,3)4/h6-11,16-17,19H,5,12-15H2,1-4H3,(H,32,35)

InChI Key

OLYNMZAGWRFYHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14931182

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.630

Distribution Coefficient, logD

6.630

Water Solubility, LogSw

-5.55

Polar Surface Area

57.236

Acid Dissociation Constant (pKa)

11.68

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.30

References: we are preparing a list of scientific research reports with E955-0743 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E955-0743?
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What is the minimum amount of E955-0743 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E955-0743
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E955-0743
  • 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 E955-0743 available by request