T633-1664 Screening compound: 1-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-3-(4-methoxyphenyl)propan-1-one

T633-1664 Screening compound: 1-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-3-(4-methoxyphenyl)propan-1-one
T633-1664 Screening compound: 1-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-3-(4-methoxyphenyl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T633-1664
1-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-3-(4-methoxyphenyl)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

T633-1664

Molecular Formula

C19H26N4O2 (C19 H26 N4 O2)

Compound Name

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

IUPAC name

1-[3-(4-ethyl-4H-124-triazol-3-yl)piperidin-1-yl]-3-(4-methoxyphenyl)propan-1-one

SMILES

CCn1c(C(CCC2)CN2C(CCc(cc2)ccc2OC)=O)nnc1

InChI

InChI=1S/C19H26N4O2/c1-3-22-14-20-21-19(22)16-5-4-12-23(13-16)18(24)11-8-15-6-9-17(25-2)10-7-15/h6-7,9-10,14,16H,3-5,8,11-13H2,1-2H3/t16-/m0/s1

InChI Key

UUIXSUJZZBLBDE-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27622744

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.888

Distribution Coefficient, logD

1.886

Water Solubility, LogSw

-2.05

Polar Surface Area

47.918

Acid Dissociation Constant (pKa)

21.70

Base Dissociation Constant (pKb)

7.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.63

T633-1664 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with T633-1664 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T633-1664?
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What is the minimum amount of T633-1664 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T633-1664
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T633-1664
  • 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 T633-1664 available by request