6228-1357 Screening compound: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-cycloheptylbenzamide

6228-1357 Screening compound: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-cycloheptylbenzamide
6228-1357 Screening compound: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-cycloheptylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6228-1357
3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-cycloheptylbenzamide

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

6228-1357

Molecular Formula

C20H26BrN3O (C20 H26 BrN3 O)

Compound Name

3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-cycloheptylbenzamide

IUPAC name

3-[(4-bromo-35-dimethyl-1H-pyrazol-1-yl)methyl]-N-cycloheptylbenzamide

SMILES

Cc(n(Cc1cc(C(NC2CCCCCC2)=O)ccc1)nc1C)c1Br

InChI

InChI=1S/C20H26BrN3O/c1-14-19(21)15(2)24(23-14)13-16-8-7-9-17(12-16)20(25)22-18-10-5-3-4-6-11-18/h7-9,12,18H,3-6,10-11,13H2,1-2H3,(H,22,25)

InChI Key

VLYFVNUOYPSQRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01893368

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.163

Distribution Coefficient, logD

4.163

Water Solubility, LogSw

-4.29

Polar Surface Area

38.990

Acid Dissociation Constant (pKa)

12.97

Base Dissociation Constant (pKb)

0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 6228-1357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6228-1357?
Check Price and Availability of 6228-1357, 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 6228-1357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6228-1357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6228-1357
  • 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 6228-1357 available by request