T505-0108 Screening compound: 1-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidin-1-yl}propan-1-one

T505-0108 Screening compound: 1-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidin-1-yl}propan-1-one
T505-0108 Screening compound: 1-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidin-1-yl}propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T505-0108
1-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidin-1-yl}propan-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

T505-0108

Molecular Formula

C18H24N4O (C18 H24 N4 O)

Compound Name

1-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidin-1-yl}propan-1-one

IUPAC name

1-{2-[2-(4-phenyl-1H-123-triazol-1-yl)ethyl]piperidin-1-yl}propan-1-one

SMILES

CCC(N1C(CCn2nnc(-c3ccccc3)c2)CCCC1)=O

InChI

InChI=1S/C18H24N4O/c1-2-18(23)22-12-7-6-10-16(22)11-13-21-14-17(19-20-21)15-8-4-3-5-9-15/h3-5,8-9,14,16H,2,6-7,10-13H2,1H3/t16-/m1/s1

InChI Key

NBIUEJXFXCQEMS-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD32261972

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.024

Distribution Coefficient, logD

3.024

Water Solubility, LogSw

-2.88

Polar Surface Area

42.497

Acid Dissociation Constant (pKa)

24.68

Base Dissociation Constant (pKb)

1.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with T505-0108 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T505-0108?
Check Price and Availability of T505-0108, 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 T505-0108 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T505-0108
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T505-0108
  • 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 T505-0108 available by request