E955-2357 Screening compound: tert-butyl 4-{1-(2,4-dimethylphenyl)-4-[(4-ethylpiperazino)carbonyl]-1H-pyrazol-5-yl}tetrahydro-1(2H)-pyridinecarboxylate

E955-2357 Screening compound: tert-butyl 4-{1-(2,4-dimethylphenyl)-4-[(4-ethylpiperazino)carbonyl]-1H-pyrazol-5-yl}tetrahydro-1(2H)-pyridinecarboxylate
E955-2357 Screening compound: tert-butyl 4-{1-(2,4-dimethylphenyl)-4-[(4-ethylpiperazino)carbonyl]-1H-pyrazol-5-yl}tetrahydro-1(2H)-pyridinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E955-2357
tert-butyl 4-{1-(2,4-dimethylphenyl)-4-[(4-ethylpiperazino)carbonyl]-1H-pyrazol-5-yl}tetrahydro-1(2H)-pyridinecarboxylate

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

E955-2357

Molecular Formula

C28H41N5O3 (C28 H41 N5 O3)

Compound Name

tert-butyl 4-{1-(2,4-dimethylphenyl)-4-[(4-ethylpiperazino)carbonyl]-1H-pyrazol-5-yl}tetrahydro-1(2H)-pyridinecarboxylate

IUPAC name

tert-butyl 4-[1-(24-dimethylphenyl)-4-(4-ethylpiperazine-1-carbonyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate

SMILES

CCN(CC1)CCN1C(c1c(C(CC2)CCN2C(OC(C)(C)C)=O)n(-c2c(C)cc(C)cc2)nc1)=O

InChI

InChI=1S/C28H41N5O3/c1-7-30-14-16-31(17-15-30)26(34)23-19-29-33(24-9-8-20(2)18-21(24)3)25(23)22-10-12-32(13-11-22)27(35)36-28(4,5)6/h8-9,18-19,22H,7,10-17H2,1-6H3

InChI Key

WVWLVNSUFVSCCC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14931784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.67

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.434

Distribution Coefficient, logD

5.258

Water Solubility, LogSw

-5.23

Polar Surface Area

55.027

Acid Dissociation Constant (pKa)

22.01

Base Dissociation Constant (pKb)

7.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.71

References: we are preparing a list of scientific research reports with E955-2357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E955-2357?
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What is the minimum amount of E955-2357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E955-2357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E955-2357
  • 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 E955-2357 available by request