SA21-0383 Screening compound: 1-[3-(1-cyclopentyl-1H-1,2,3,4-tetrazol-5-yl)-3-(dimethylamino)pyrrolidin-1-yl]-2-(2-methylphenyl)ethan-1-one

SA21-0383 Screening compound: 1-[3-(1-cyclopentyl-1H-1,2,3,4-tetrazol-5-yl)-3-(dimethylamino)pyrrolidin-1-yl]-2-(2-methylphenyl)ethan-1-one
SA21-0383 Screening compound: 1-[3-(1-cyclopentyl-1H-1,2,3,4-tetrazol-5-yl)-3-(dimethylamino)pyrrolidin-1-yl]-2-(2-methylphenyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SA21-0383
1-[3-(1-cyclopentyl-1H-1,2,3,4-tetrazol-5-yl)-3-(dimethylamino)pyrrolidin-1-yl]-2-(2-methylphenyl)ethan-1-one

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

SA21-0383

Molecular Formula

C21H30N6O (C21 H30 N6 O)

Compound Name

1-[3-(1-cyclopentyl-1H-1,2,3,4-tetrazol-5-yl)-3-(dimethylamino)pyrrolidin-1-yl]-2-(2-methylphenyl)ethan-1-one

IUPAC name

1-[3-(1-cyclopentyl-1H-1234-tetrazol-5-yl)-3-(dimethylamino)pyrrolidin-1-yl]-2-(2-methylphenyl)ethan-1-one

SMILES

Cc1c(CC(N(CC2)CC2(c2nnnn2C2CCCC2)N(C)C)=O)cccc1

InChI

InChI=1S/C21H30N6O/c1-16-8-4-5-9-17(16)14-19(28)26-13-12-21(15-26,25(2)3)20-22-23-24-27(20)18-10-6-7-11-18/h4-5,8-9,18H,6-7,10-15H2,1-3H3/t21-/m0/s1

InChI Key

IEJYRWWYGBCBFJ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD32235299

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.192

Distribution Coefficient, logD

3.166

Water Solubility, LogSw

-3.07

Polar Surface Area

58.355

Acid Dissociation Constant (pKa)

17.58

Base Dissociation Constant (pKb)

6.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.90

SA21-0383 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA21-0383 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA21-0383?
Check Price and Availability of SA21-0383, 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 SA21-0383 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA21-0383
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA21-0383
  • 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 SA21-0383 available by request