SC12-0502 Screening compound: 2-bromo-5-methoxy-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-N-tetrahydro-2H-pyran-4-ylbenzamide

SC12-0502 Screening compound: 2-bromo-5-methoxy-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-N-tetrahydro-2H-pyran-4-ylbenzamide
SC12-0502 Screening compound: 2-bromo-5-methoxy-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-N-tetrahydro-2H-pyran-4-ylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC12-0502
2-bromo-5-methoxy-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-N-tetrahydro-2H-pyran-4-ylbenzamide

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

SC12-0502

Molecular Formula

C20H27BrN2O4 (C20 H27 BrN2 O4)

Compound Name

2-bromo-5-methoxy-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-N-tetrahydro-2H-pyran-4-ylbenzamide

IUPAC name

2-bromo-5-methoxy-N-(oxan-4-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide

SMILES

COc(cc1)cc(C(N(CCCN(CCC2)C2=O)C2CCOCC2)=O)c1Br

InChI

InChI=1S/C20H27BrN2O4/c1-26-16-5-6-18(21)17(14-16)20(25)23(15-7-12-27-13-8-15)11-3-10-22-9-2-4-19(22)24/h5-6,14-15H,2-4,7-13H2,1H3

InChI Key

ZEZQRHQQVRGELG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32254691

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.918

Distribution Coefficient, logD

1.918

Water Solubility, LogSw

-2.54

Polar Surface Area

48.365

Acid Dissociation Constant (pKa)

16.88

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

References: we are preparing a list of scientific research reports with SC12-0502 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC12-0502?
Check Price and Availability of SC12-0502, 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 SC12-0502 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC12-0502
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC12-0502
  • 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 SC12-0502 available by request