F208-0335 Screening compound: 4-[(5E)-5-[(4-chlorophenyl)imino]-3,3-dimethyl-4-(morpholin-4-yl)-2-sulfanylidenepyrrolidin-1-yl]benzonitrile

F208-0335 Screening compound: 4-[(5E)-5-[(4-chlorophenyl)imino]-3,3-dimethyl-4-(morpholin-4-yl)-2-sulfanylidenepyrrolidin-1-yl]benzonitrile
F208-0335 Screening compound: 4-[(5E)-5-[(4-chlorophenyl)imino]-3,3-dimethyl-4-(morpholin-4-yl)-2-sulfanylidenepyrrolidin-1-yl]benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound F208-0335
4-[(5E)-5-[(4-chlorophenyl)imino]-3,3-dimethyl-4-(morpholin-4-yl)-2-sulfanylidenepyrrolidin-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

F208-0335

Molecular Formula

C23H23ClN4OS (C23 H23 ClN4 OS)

Compound Name

4-[(5E)-5-[(4-chlorophenyl)imino]-3,3-dimethyl-4-(morpholin-4-yl)-2-sulfanylidenepyrrolidin-1-yl]benzonitrile

IUPAC name

4-[(5E)-5-[(4-chlorophenyl)imino]-33-dimethyl-4-(morpholin-4-yl)-2-sulfanylidenepyrrolidin-1-yl]benzonitrile

SMILES

CC(C)(C(/C(/N1c(cc2)ccc2C#N)=N\c(cc2)ccc2Cl)N2CCOCC2)C1=S

InChI

InChI=1S/C23H23ClN4OS/c1-23(2)20(27-11-13-29-14-12-27)21(26-18-7-5-17(24)6-8-18)28(22(23)30)19-9-3-16(15-25)4-10-19/h3-10,20H,11-14H2,1-2H3/t20-/m1/s1

InChI Key

XVZRZSOZALFLCW-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD14944754

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.98

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.559

Distribution Coefficient, logD

4.559

Water Solubility, LogSw

-4.73

Polar Surface Area

37.101

Acid Dissociation Constant (pKa)

17.27

Base Dissociation Constant (pKb)

3.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.80

F208-0335 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 F208-0335 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F208-0335?
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What is the minimum amount of F208-0335 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F208-0335
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F208-0335
  • 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 F208-0335 available by request