CM3593-1562 Screening compound: 3-{[4-(methoxymethyl)-1H-1,2,3-triazol-1-yl]methyl}-1-tetrahydro-2H-pyran-4-ylpiperidine

CM3593-1562 Screening compound: 3-{[4-(methoxymethyl)-1H-1,2,3-triazol-1-yl]methyl}-1-tetrahydro-2H-pyran-4-ylpiperidine
CM3593-1562 Screening compound: 3-{[4-(methoxymethyl)-1H-1,2,3-triazol-1-yl]methyl}-1-tetrahydro-2H-pyran-4-ylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound CM3593-1562
3-{[4-(methoxymethyl)-1H-1,2,3-triazol-1-yl]methyl}-1-tetrahydro-2H-pyran-4-ylpiperidine

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

CM3593-1562

Molecular Formula

C15H26N4O2 (C15 H26 N4 O2)

Compound Name

3-{[4-(methoxymethyl)-1H-1,2,3-triazol-1-yl]methyl}-1-tetrahydro-2H-pyran-4-ylpiperidine

IUPAC name

3-{[4-(methoxymethyl)-1H-123-triazol-1-yl]methyl}-1-(oxan-4-yl)piperidine

SMILES

COCc1cn(CC(CCC2)CN2C2CCOCC2)nn1

InChI

InChI=1S/C15H26N4O2/c1-20-12-14-11-19(17-16-14)10-13-3-2-6-18(9-13)15-4-7-21-8-5-15/h11,13,15H,2-10,12H2,1H3/t13-/m0/s1

InChI Key

BEDVIGHBIYQXGR-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD30465566

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

294.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.711

Distribution Coefficient, logD

-1.325

Water Solubility, LogSw

-0.37

Polar Surface Area

46.798

Acid Dissociation Constant (pKa)

25.60

Base Dissociation Constant (pKb)

9.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

86.67

CM3593-1562 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with CM3593-1562 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM3593-1562?
Check Price and Availability of CM3593-1562, 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 CM3593-1562 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM3593-1562
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM3593-1562
  • 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 CM3593-1562 available by request