S632-1382 Screening compound: ((3S,4S)-4-{1-[3-(trifluoromethyl)benzyl]-4-piperidyl}tetrahydro-1H-pyrrol-3-yl)methanol

S632-1382 Screening compound: ((3S,4S)-4-{1-[3-(trifluoromethyl)benzyl]-4-piperidyl}tetrahydro-1H-pyrrol-3-yl)methanol
S632-1382 Screening compound: ((3S,4S)-4-{1-[3-(trifluoromethyl)benzyl]-4-piperidyl}tetrahydro-1H-pyrrol-3-yl)methanol alternative view

Chemical Structure Depiction of ChemDiv screening compound S632-1382
((3S,4S)-4-{1-[3-(trifluoromethyl)benzyl]-4-piperidyl}tetrahydro-1H-pyrrol-3-yl)methanol

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

S632-1382

Molecular Formula

C18H25F3N2O (C18 H25 F3 N2 O)

Compound Name

((3S,4S)-4-{1-[3-(trifluoromethyl)benzyl]-4-piperidyl}tetrahydro-1H-pyrrol-3-yl)methanol

IUPAC name

n/a

SMILES

OC[C@@H](CNC1)[C@H]1C1CCN(Cc2cccc(C(F)(F)F)c2)CC1

InChI

InChI=1S/C18H25F3N2O/c19-18(20,21)16-3-1-2-13(8-16)11-23-6-4-14(5-7-23)17-10-22-9-15(17)12-24/h1-3,8,14-15,17,22,24H,4-7,9-12H2/t15-,17-/m1/s1

InChI Key

FQRDNTTXSJAEKF-NVXWUHKLSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

342.4

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.399

Distribution Coefficient, logD

-0.943

Water Solubility, LogSw

-2.29

Polar Surface Area

33.196

Acid Dissociation Constant (pKa)

15.98

Base Dissociation Constant (pKb)

10.74

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

66.70

S632-1382 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with S632-1382 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S632-1382?
Check Price and Availability of S632-1382, 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 S632-1382 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S632-1382
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S632-1382
  • 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 S632-1382 available by request