S421-0875 Screening compound: 3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1-[3-(2-MORPHOLINO-2-OXOETHYL)-1-PYRROLIDINYL]-1-PROPANONE

S421-0875 Screening compound: 3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1-[3-(2-MORPHOLINO-2-OXOETHYL)-1-PYRROLIDINYL]-1-PROPANONE
S421-0875 Screening compound: 3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1-[3-(2-MORPHOLINO-2-OXOETHYL)-1-PYRROLIDINYL]-1-PROPANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound S421-0875
3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1-[3-(2-MORPHOLINO-2-OXOETHYL)-1-PYRROLIDINYL]-1-PROPANONE

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

S421-0875

Molecular Formula

C18H28N4O3 (C18 H28 N4 O3)

Compound Name

3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1-[3-(2-MORPHOLINO-2-OXOETHYL)-1-PYRROLIDINYL]-1-PROPANONE

IUPAC name

n/a

SMILES

Cc1cc(C)nn1CCC(N1CC(CC(N2CCOCC2)=O)CC1)=O

InChI

InChI=1S/C18H28N4O3/c1-14-11-15(2)22(19-14)6-4-17(23)21-5-3-16(13-21)12-18(24)20-7-9-25-10-8-20/h11,16H,3-10,12-13H2,1-2H3/t16-/m1/s1

InChI Key

MTKQXRIWOKFBOT-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD29009530

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.412

Distribution Coefficient, logD

-0.413

Water Solubility, LogSw

-0.52

Polar Surface Area

54.674

Acid Dissociation Constant (pKa)

23.47

Base Dissociation Constant (pKb)

4.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

72.20

References: we are preparing a list of scientific research reports with S421-0875 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S421-0875?
Check Price and Availability of S421-0875, 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 S421-0875 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S421-0875
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S421-0875
  • 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 S421-0875 available by request