F208-0247 Screening compound: (2'E)-2'-(tert-butylimino)-1'-(2-chlorophenyl)-4',4'-dimethyl-[1,3'-bipyrrolidine]-5'-thione

F208-0247 Screening compound: (2'E)-2'-(tert-butylimino)-1'-(2-chlorophenyl)-4',4'-dimethyl-[1,3'-bipyrrolidine]-5'-thione
F208-0247 Screening compound: (2'E)-2'-(tert-butylimino)-1'-(2-chlorophenyl)-4',4'-dimethyl-[1,3'-bipyrrolidine]-5'-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound F208-0247
(2'E)-2'-(tert-butylimino)-1'-(2-chlorophenyl)-4',4'-dimethyl-[1,3'-bipyrrolidine]-5'-thione

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

F208-0247

Molecular Formula

C20H28ClN3S (C20 H28 ClN3 S)

Compound Name

(2'E)-2'-(tert-butylimino)-1'-(2-chlorophenyl)-4',4'-dimethyl-[1,3'-bipyrrolidine]-5'-thione

IUPAC name

(2'E)-2'-(tert-butylimino)-1'-(2-chlorophenyl)-4'4'-dimethyl-[13'-bipyrrolidine]-5'-thione

SMILES

CC(C)(C)/N=C(\C(C(C)(C)C1=S)N2CCCC2)/N1c(cccc1)c1Cl

InChI

InChI=1S/C20H28ClN3S/c1-19(2,3)22-17-16(23-12-8-9-13-23)20(4,5)18(25)24(17)15-11-7-6-10-14(15)21/h6-7,10-11,16H,8-9,12-13H2,1-5H3/t16-/m0/s1

InChI Key

KPOIIIAZYYLYRA-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14944724

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.98

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.892

Distribution Coefficient, logD

4.891

Water Solubility, LogSw

-4.95

Polar Surface Area

12.619

Acid Dissociation Constant (pKa)

19.77

Base Dissociation Constant (pKb)

3.92

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

F208-0247 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 F208-0247 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F208-0247?
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What is the minimum amount of F208-0247 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F208-0247
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F208-0247
  • 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 F208-0247 available by request