8007-1153 Screening compound: 4-(2,4-dimethylphenyl)-1,2,5-trimethylpiperidin-4-ol

8007-1153 Screening compound: 4-(2,4-dimethylphenyl)-1,2,5-trimethylpiperidin-4-ol
8007-1153 Screening compound: 4-(2,4-dimethylphenyl)-1,2,5-trimethylpiperidin-4-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-1153
4-(2,4-dimethylphenyl)-1,2,5-trimethylpiperidin-4-ol

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

8007-1153

Molecular Formula

C16H25NO (C16 H25 NO)

Compound Name

4-(2,4-dimethylphenyl)-1,2,5-trimethylpiperidin-4-ol

IUPAC name

4-(24-dimethylphenyl)-125-trimethylpiperidin-4-ol

SMILES

CC(CN(C)C(C)C1)C1(c1c(C)cc(C)cc1)O

InChI

InChI=1S/C16H25NO/c1-11-6-7-15(12(2)8-11)16(18)9-14(4)17(5)10-13(16)3/h6-8,13-14,18H,9-10H2,1-5H3

InChI Key

BNPBCKRXUQEEPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00446909

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

247.38

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.211

Distribution Coefficient, logD

0.599

Water Solubility, LogSw

-2.96

Polar Surface Area

18.069

Acid Dissociation Constant (pKa)

15.60

Base Dissociation Constant (pKb)

10.01

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

62.50

8007-1153 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

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

CNS BBB Library (22607 compounds)

Soluble Diversity Library (15920 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Nervous system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8007-1153 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-1153?
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What is the minimum amount of 8007-1153 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-1153
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-1153
  • 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 8007-1153 available by request