E614-0502 Screening compound: 1-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]-4-cyclohexylpiperazine

E614-0502 Screening compound: 1-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]-4-cyclohexylpiperazine
E614-0502 Screening compound: 1-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]-4-cyclohexylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E614-0502
1-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]-4-cyclohexylpiperazine

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

E614-0502

Molecular Formula

C20H25BrN4O (C20 H25 BrN4 O)

Compound Name

1-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]-4-cyclohexylpiperazine

IUPAC name

1-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]-4-cyclohexylpiperazine

SMILES

O=C(c1cc(-c(cc2)ccc2Br)n[nH]1)N(CC1)CCN1C1CCCCC1

InChI

InChI=1S/C20H25BrN4O/c21-16-8-6-15(7-9-16)18-14-19(23-22-18)20(26)25-12-10-24(11-13-25)17-4-2-1-3-5-17/h6-9,14,17H,1-5,10-13H2,(H,22,23)

InChI Key

FSTZMZYJXIEXDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14904499

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.567

Distribution Coefficient, logD

4.404

Water Solubility, LogSw

-4.30

Polar Surface Area

42.470

Acid Dissociation Constant (pKa)

10.31

Base Dissociation Constant (pKb)

7.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

E614-0502 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Immunological Library (6760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Immune system

References: we are preparing a list of scientific research reports with E614-0502 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E614-0502?
Check Price and Availability of E614-0502, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E614-0502 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E614-0502
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E614-0502
  • 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 E614-0502 available by request