SC91-0533 Screening compound: (6R,7aS)-6-(2-chlorophenyl)-6-(piperidinocarbonyl)hexahydro-3H-pyrrolizin-3-one

SC91-0533 Screening compound: (6R,7aS)-6-(2-chlorophenyl)-6-(piperidinocarbonyl)hexahydro-3H-pyrrolizin-3-one
SC91-0533 Screening compound: (6R,7aS)-6-(2-chlorophenyl)-6-(piperidinocarbonyl)hexahydro-3H-pyrrolizin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SC91-0533
(6R,7aS)-6-(2-chlorophenyl)-6-(piperidinocarbonyl)hexahydro-3H-pyrrolizin-3-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

SC91-0533

Molecular Formula

C19H23ClN2O2 (C19 H23 ClN2 O2)

Compound Name

(6R,7aS)-6-(2-chlorophenyl)-6-(piperidinocarbonyl)hexahydro-3H-pyrrolizin-3-one

IUPAC name

n/a

SMILES

O=C([C@](C[C@H]1CC2)(CN1C2=O)c(cccc1)c1Cl)N1CCCCC1

InChI

InChI=1S/C19H23ClN2O2/c20-16-7-3-2-6-15(16)19(18(24)21-10-4-1-5-11-21)12-14-8-9-17(23)22(14)13-19/h2-3,6-7,14H,1,4-5,8-13H2/t14-,19+/m0/s1

InChI Key

MPVGUNQOJQHURR-IFXJQAMLSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.86

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.601

Distribution Coefficient, logD

2.601

Water Solubility, LogSw

-3.49

Polar Surface Area

34.162

Acid Dissociation Constant (pKa)

15.64

Base Dissociation Constant (pKb)

-2.54

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

57.89

References: we are preparing a list of scientific research reports with SC91-0533 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC91-0533?
Check Price and Availability of SC91-0533, 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 SC91-0533 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC91-0533
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC91-0533
  • 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 SC91-0533 available by request