S632-7093 Screening compound: tert-butyl 3-(hydroxymethyl)-4-(piperidin-4-yl)pyrrolidine-1-carboxylate

S632-7093 Screening compound: tert-butyl 3-(hydroxymethyl)-4-(piperidin-4-yl)pyrrolidine-1-carboxylate
S632-7093 Screening compound: tert-butyl 3-(hydroxymethyl)-4-(piperidin-4-yl)pyrrolidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound S632-7093
tert-butyl 3-(hydroxymethyl)-4-(piperidin-4-yl)pyrrolidine-1-carboxylate

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

S632-7093

Molecular Formula

C15H28N2O3 (C15 H28 N2 O3)

Compound Name

tert-butyl 3-(hydroxymethyl)-4-(piperidin-4-yl)pyrrolidine-1-carboxylate

IUPAC name

tert-butyl (3S4S)-3-(hydroxymethyl)-4-(piperidin-4-yl)pyrrolidine-1-carboxylate

SMILES

CC(C)(C)OC(N(C[C@@H]1CO)C[C@@H]1C1CCNCC1)=O

InChI

InChI=1S/C15H28N2O3/c1-15(2,3)20-14(19)17-8-12(10-18)13(9-17)11-4-6-16-7-5-11/h11-13,16,18H,4-10H2,1-3H3/t12-,13-/m0/s1

InChI Key

NSEOXACNAWPQNZ-STQMWFEESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

284.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.785

Distribution Coefficient, logD

-1.631

Water Solubility, LogSw

-1.23

Polar Surface Area

51.549

Acid Dissociation Constant (pKa)

15.98

Base Dissociation Constant (pKb)

9.81

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

93.30

S632-7093 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with S632-7093 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S632-7093?
Check Price and Availability of S632-7093, 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 S632-7093 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S632-7093
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S632-7093
  • 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 S632-7093 available by request