G239-0454 Screening compound: ethyl 3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanamido]benzoate

G239-0454 Screening compound: ethyl 3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanamido]benzoate
G239-0454 Screening compound: ethyl 3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G239-0454
ethyl 3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanamido]benzoate

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

G239-0454

Molecular Formula

C17H21N3O3 (C17 H21 N3 O3)

Compound Name

ethyl 3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanamido]benzoate

IUPAC name

ethyl 3-[3-(35-dimethyl-1H-pyrazol-1-yl)propanamido]benzoate

SMILES

CCOC(c1cc(NC(CCn2nc(C)cc2C)=O)ccc1)=O

InChI

InChI=1S/C17H21N3O3/c1-4-23-17(22)14-6-5-7-15(11-14)18-16(21)8-9-20-13(3)10-12(2)19-20/h5-7,10-11H,4,8-9H2,1-3H3,(H,18,21)

InChI Key

OUDWVOUXGNJKAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14989235

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.333

Distribution Coefficient, logD

2.333

Water Solubility, LogSw

-2.82

Polar Surface Area

57.855

Acid Dissociation Constant (pKa)

11.74

Base Dissociation Constant (pKb)

2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

References: we are preparing a list of scientific research reports with G239-0454 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G239-0454?
Check Price and Availability of G239-0454, 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 G239-0454 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G239-0454
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G239-0454
  • 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 G239-0454 available by request