SC02-0325 Screening compound: N-[3-(2-methoxyethyl)-1-{[4-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]benzenesulfonamide

SC02-0325 Screening compound: N-[3-(2-methoxyethyl)-1-{[4-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]benzenesulfonamide
SC02-0325 Screening compound: N-[3-(2-methoxyethyl)-1-{[4-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC02-0325
N-[3-(2-methoxyethyl)-1-{[4-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]benzenesulfonamide

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

SC02-0325

Molecular Formula

C21H25F3N2O3S (C21 H25 F3 N2 O3 S)

Compound Name

N-[3-(2-methoxyethyl)-1-{[4-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]benzenesulfonamide

IUPAC name

N-[3-(2-methoxyethyl)-1-{[4-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]benzenesulfonamide

SMILES

COCCC1(CN(Cc2ccc(C(F)(F)F)cc2)CC1)NS(c1ccccc1)(=O)=O

InChI

InChI=1S/C21H25F3N2O3S/c1-29-14-12-20(25-30(27,28)19-5-3-2-4-6-19)11-13-26(16-20)15-17-7-9-18(10-8-17)21(22,23)24/h2-10,25H,11-16H2,1H3/t20-/m1/s1

InChI Key

VOVWJCAGMGAOGD-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD32252292

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.487

Distribution Coefficient, logD

2.909

Water Solubility, LogSw

-3.79

Polar Surface Area

54.435

Acid Dissociation Constant (pKa)

11.34

Base Dissociation Constant (pKb)

7.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.86

SC02-0325 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SC02-0325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC02-0325?
Check Price and Availability of SC02-0325, 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 SC02-0325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC02-0325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC02-0325
  • 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 SC02-0325 available by request