V027-2171 Screening compound: N-cyclohexyl-4-{[(5Z)-2,4-dioxo-3-{[4-(trifluoromethyl)phenyl]methyl}-1,3-thiazolidin-5-ylidene]methyl}-N-methylbenzamide

V027-2171 Screening compound: N-cyclohexyl-4-{[(5Z)-2,4-dioxo-3-{[4-(trifluoromethyl)phenyl]methyl}-1,3-thiazolidin-5-ylidene]methyl}-N-methylbenzamide
V027-2171 Screening compound: N-cyclohexyl-4-{[(5Z)-2,4-dioxo-3-{[4-(trifluoromethyl)phenyl]methyl}-1,3-thiazolidin-5-ylidene]methyl}-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-2171
N-cyclohexyl-4-{[(5Z)-2,4-dioxo-3-{[4-(trifluoromethyl)phenyl]methyl}-1,3-thiazolidin-5-ylidene]methyl}-N-methylbenzamide

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

V027-2171

Molecular Formula

C26H25F3N2O3S (C26 H25 F3 N2 O3 S)

Compound Name

N-cyclohexyl-4-{[(5Z)-2,4-dioxo-3-{[4-(trifluoromethyl)phenyl]methyl}-1,3-thiazolidin-5-ylidene]methyl}-N-methylbenzamide

IUPAC name

N-cyclohexyl-4-{[(5Z)-24-dioxo-3-{[4-(trifluoromethyl)phenyl]methyl}-13-thiazolidin-5-ylidene]methyl}-N-methylbenzamide

SMILES

CN(C1CCCCC1)C(c1ccc(/C=C(/C(N2Cc3ccc(C(F)(F)F)cc3)=O)\SC2=O)cc1)=O

InChI

InChI=1S/C26H25F3N2O3S/c1-30(21-5-3-2-4-6-21)23(32)19-11-7-17(8-12-19)15-22-24(33)31(25(34)35-22)16-18-9-13-20(14-10-18)26(27,28)29/h7-15,21H,2-6,16H2,1H3

InChI Key

IFLYTCZSSAWKQK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19934577

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

502.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.978

Distribution Coefficient, logD

5.978

Water Solubility, LogSw

-5.43

Polar Surface Area

44.798

Acid Dissociation Constant (pKa)

27.13

Base Dissociation Constant (pKb)

-1.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with V027-2171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-2171?
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What is the minimum amount of V027-2171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-2171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-2171
  • 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 V027-2171 available by request