CM3593-4806 Screening compound: 2,3-DIHYDRO-1H-INDEN-5-YL ({1-[(1-METHYL-3-PIPERIDYL)METHYL]-1H-1,2,3-TRIAZOL-4-YL}METHYL) ETHER

CM3593-4806 Screening compound: 2,3-DIHYDRO-1H-INDEN-5-YL ({1-[(1-METHYL-3-PIPERIDYL)METHYL]-1H-1,2,3-TRIAZOL-4-YL}METHYL) ETHER
CM3593-4806 Screening compound: 2,3-DIHYDRO-1H-INDEN-5-YL ({1-[(1-METHYL-3-PIPERIDYL)METHYL]-1H-1,2,3-TRIAZOL-4-YL}METHYL) ETHER alternative view

Chemical Structure Depiction of ChemDiv screening compound CM3593-4806
2,3-DIHYDRO-1H-INDEN-5-YL ({1-[(1-METHYL-3-PIPERIDYL)METHYL]-1H-1,2,3-TRIAZOL-4-YL}METHYL) ETHER

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

CM3593-4806

Molecular Formula

C19H26N4O (C19 H26 N4 O)

Compound Name

2,3-DIHYDRO-1H-INDEN-5-YL ({1-[(1-METHYL-3-PIPERIDYL)METHYL]-1H-1,2,3-TRIAZOL-4-YL}METHYL) ETHER

IUPAC name

3-({4-[(23-dihydro-1H-inden-5-yloxy)methyl]-1H-123-triazol-1-yl}methyl)-1-methylpiperidine

SMILES

CN1CC(Cn2nnc(COc3cc(CCC4)c4cc3)c2)CCC1

InChI

InChI=1S/C19H26N4O/c1-22-9-3-4-15(11-22)12-23-13-18(20-21-23)14-24-19-8-7-16-5-2-6-17(16)10-19/h7-8,10,13,15H,2-6,9,11-12,14H2,1H3/t15-/m0/s1

InChI Key

YONAMYQSHQHOLT-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD30465559

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.889

Distribution Coefficient, logD

1.125

Water Solubility, LogSw

-3.03

Polar Surface Area

38.363

Acid Dissociation Constant (pKa)

20.77

Base Dissociation Constant (pKb)

9.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.90

CM3593-4806 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS MPO Library (28609 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with CM3593-4806 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM3593-4806?
Check Price and Availability of CM3593-4806, 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 CM3593-4806 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM3593-4806
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM3593-4806
  • 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 CM3593-4806 available by request