S620-0373 Screening compound: N,N-DIMETHYL-N-[(3S,4S)-1-[(1-METHYL-1H-INDOL-3-YL)METHYL]-4-(3-METHYL-1H-1,2,4-TRIAZOL-5-YL)HEXAHYDRO-3-PYRIDINYL]AMINE

S620-0373 Screening compound: N,N-DIMETHYL-N-[(3S,4S)-1-[(1-METHYL-1H-INDOL-3-YL)METHYL]-4-(3-METHYL-1H-1,2,4-TRIAZOL-5-YL)HEXAHYDRO-3-PYRIDINYL]AMINE
S620-0373 Screening compound: N,N-DIMETHYL-N-[(3S,4S)-1-[(1-METHYL-1H-INDOL-3-YL)METHYL]-4-(3-METHYL-1H-1,2,4-TRIAZOL-5-YL)HEXAHYDRO-3-PYRIDINYL]AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound S620-0373
N,N-DIMETHYL-N-[(3S,4S)-1-[(1-METHYL-1H-INDOL-3-YL)METHYL]-4-(3-METHYL-1H-1,2,4-TRIAZOL-5-YL)HEXAHYDRO-3-PYRIDINYL]AMINE

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

S620-0373

Molecular Formula

C20H28N6 (C20 H28 N6)

Compound Name

N,N-DIMETHYL-N-[(3S,4S)-1-[(1-METHYL-1H-INDOL-3-YL)METHYL]-4-(3-METHYL-1H-1,2,4-TRIAZOL-5-YL)HEXAHYDRO-3-PYRIDINYL]AMINE

IUPAC name

(3S4S)-NN-dimethyl-4-(3-methyl-1H-124-triazol-5-yl)-1-[(1-methyl-1H-indol-3-yl)methyl]piperidin-3-amine

SMILES

Cc1n[nH]c([C@H](CCN(Cc2cn(C)c3c2cccc3)C2)[C@H]2N(C)C)n1

InChI

InChI=1S/C20H28N6/c1-14-21-20(23-22-14)17-9-10-26(13-19(17)24(2)3)12-15-11-25(4)18-8-6-5-7-16(15)18/h5-8,11,17,19H,9-10,12-13H2,1-4H3,(H,21,22,23)/t17-,19+/m1/s1

InChI Key

NYLFKKRUUFPPMQ-MJGOQNOKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.766

Distribution Coefficient, logD

-1.106

Water Solubility, LogSw

-2.11

Polar Surface Area

41.773

Acid Dissociation Constant (pKa)

10.37

Base Dissociation Constant (pKb)

10.27

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

50.00

S620-0373 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Agro:
  • Agro

References: we are preparing a list of scientific research reports with S620-0373 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S620-0373?
Check Price and Availability of S620-0373, 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 S620-0373 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S620-0373
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S620-0373
  • 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 S620-0373 available by request