3270-0841 Screening compound: (2E,5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-cyclohexyl-2-(phenylimino)-1,3-thiazolidin-4-one

3270-0841 Screening compound: (2E,5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-cyclohexyl-2-(phenylimino)-1,3-thiazolidin-4-one
3270-0841 Screening compound: (2E,5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-cyclohexyl-2-(phenylimino)-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3270-0841
(2E,5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-cyclohexyl-2-(phenylimino)-1,3-thiazolidin-4-one

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

3270-0841

Molecular Formula

C28H28ClN3OS (C28 H28 ClN3 OS)

Compound Name

(2E,5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-cyclohexyl-2-(phenylimino)-1,3-thiazolidin-4-one

IUPAC name

(2E5Z)-5-{[1-(4-chlorophenyl)-25-dimethyl-1H-pyrrol-3-yl]methylidene}-3-cyclohexyl-2-(phenylimino)-13-thiazolidin-4-one

SMILES

Cc1cc(/C=C(/C(N2C3CCCCC3)=O)\S/C2=N/c2ccccc2)c(C)n1-c(cc1)ccc1Cl

InChI

InChI=1S/C28H28ClN3OS/c1-19-17-21(20(2)31(19)25-15-13-22(29)14-16-25)18-26-27(33)32(24-11-7-4-8-12-24)28(34-26)30-23-9-5-3-6-10-23/h3,5-6,9-10,13-18,24H,4,7-8,11-12H2,1-2H3

InChI Key

OVMHOQGDRFINIP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02109488

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.07

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.011

Distribution Coefficient, logD

7.011

Water Solubility, LogSw

-6.21

Polar Surface Area

26.750

Acid Dissociation Constant (pKa)

28.39

Base Dissociation Constant (pKb)

0.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 3270-0841 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3270-0841?
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What is the minimum amount of 3270-0841 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3270-0841
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3270-0841
  • 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 3270-0841 available by request