T629-1882 Screening compound: 3-(4-methoxyphenyl)-1-[3-(5-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]propan-1-one

T629-1882 Screening compound: 3-(4-methoxyphenyl)-1-[3-(5-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]propan-1-one
T629-1882 Screening compound: 3-(4-methoxyphenyl)-1-[3-(5-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T629-1882
3-(4-methoxyphenyl)-1-[3-(5-methyl-4H-1,2,4-triazol-3-yl)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

T629-1882

Molecular Formula

C18H24N4O2 (C18 H24 N4 O2)

Compound Name

3-(4-methoxyphenyl)-1-[3-(5-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]propan-1-one

IUPAC name

3-(4-methoxyphenyl)-1-[3-(5-methyl-4H-124-triazol-3-yl)piperidin-1-yl]propan-1-one

SMILES

Cc1nnc(C(CCC2)CN2C(CCc(cc2)ccc2OC)=O)[nH]1

InChI

InChI=1S/C18H24N4O2/c1-13-19-18(21-20-13)15-4-3-11-22(12-15)17(23)10-7-14-5-8-16(24-2)9-6-14/h5-6,8-9,15H,3-4,7,10-12H2,1-2H3,(H,19,20,21)/t15-/m0/s1

InChI Key

OQCIGIPCPFXURN-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD29027914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.709

Distribution Coefficient, logD

1.705

Water Solubility, LogSw

-2.03

Polar Surface Area

57.234

Acid Dissociation Constant (pKa)

8.10

Base Dissociation Constant (pKb)

6.69

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

T629-1882 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with T629-1882 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T629-1882?
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What is the minimum amount of T629-1882 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T629-1882
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T629-1882
  • 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 T629-1882 available by request