F208-0261 Screening compound: 4-[(2'E)-2'-[(adamantan-1-yl)imino]-4',4'-dimethyl-5'-sulfanylidene-[1,3'-bipyrrolidin]-1'-yl]benzonitrile

F208-0261 Screening compound: 4-[(2'E)-2'-[(adamantan-1-yl)imino]-4',4'-dimethyl-5'-sulfanylidene-[1,3'-bipyrrolidin]-1'-yl]benzonitrile
F208-0261 Screening compound: 4-[(2'E)-2'-[(adamantan-1-yl)imino]-4',4'-dimethyl-5'-sulfanylidene-[1,3'-bipyrrolidin]-1'-yl]benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound F208-0261
4-[(2'E)-2'-[(adamantan-1-yl)imino]-4',4'-dimethyl-5'-sulfanylidene-[1,3'-bipyrrolidin]-1'-yl]benzonitrile

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

F208-0261

Molecular Formula

C27H34N4S (C27 H34 N4 S)

Compound Name

4-[(2'E)-2'-[(adamantan-1-yl)imino]-4',4'-dimethyl-5'-sulfanylidene-[1,3'-bipyrrolidin]-1'-yl]benzonitrile

IUPAC name

4-[(2'E)-2'-[(adamantan-1-yl)imino]-4'4'-dimethyl-5'-sulfanylidene-[13'-bipyrrolidin]-1'-yl]benzonitrile

SMILES

CC(C)(C(/C(/N1c(cc2)ccc2C#N)=N\C2(CC(C3)C4)CC4CC3C2)N2CCCC2)C1=S

InChI

InChI=1S/C27H34N4S/c1-26(2)23(30-9-3-4-10-30)24(31(25(26)32)22-7-5-18(17-28)6-8-22)29-27-14-19-11-20(15-27)13-21(12-19)16-27/h5-8,19-21,23H,3-4,9-16H2,1-2H3/t19?,20?,21?,23-,27?/m0/s1

InChI Key

DATKXTKVNMQNCR-GZMUKRDFSA-N

MDL Number (MFCD)

MFCD14944729

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.66

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.805

Distribution Coefficient, logD

5.803

Water Solubility, LogSw

-5.64

Polar Surface Area

30.576

Acid Dissociation Constant (pKa)

20.01

Base Dissociation Constant (pKb)

5.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.70

References: we are preparing a list of scientific research reports with F208-0261 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F208-0261?
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What is the minimum amount of F208-0261 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F208-0261
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F208-0261
  • 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 F208-0261 available by request