V026-3146 Screening compound: 2,4-dichloro-N-[(2Z)-3-{[3-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-2,3-dihydro-1,3-thiazol-2-ylidene]benzamide

V026-3146 Screening compound: 2,4-dichloro-N-[(2Z)-3-{[3-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-2,3-dihydro-1,3-thiazol-2-ylidene]benzamide
V026-3146 Screening compound: 2,4-dichloro-N-[(2Z)-3-{[3-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-2,3-dihydro-1,3-thiazol-2-ylidene]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-3146
2,4-dichloro-N-[(2Z)-3-{[3-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-2,3-dihydro-1,3-thiazol-2-ylidene]benzamide

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

V026-3146

Molecular Formula

C24H24Cl2N4O2S (C24 H24 Cl2 N4 O2 S)

Compound Name

2,4-dichloro-N-[(2Z)-3-{[3-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-2,3-dihydro-1,3-thiazol-2-ylidene]benzamide

IUPAC name

24-dichloro-N-[(2Z)-3-{[3-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-23-dihydro-13-thiazol-2-ylidene]benzamide

SMILES

CCN(CC1)CCN1C(c1cccc(CN(C=CS2)/C2=N/C(c(ccc(Cl)c2)c2Cl)=O)c1)=O

InChI

InChI=1S/C24H24Cl2N4O2S/c1-2-28-8-10-29(11-9-28)23(32)18-5-3-4-17(14-18)16-30-12-13-33-24(30)27-22(31)20-7-6-19(25)15-21(20)26/h3-7,12-15H,2,8-11,16H2,1H3

InChI Key

LWJKLWLWQGKHTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19796891

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

503.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.006

Distribution Coefficient, logD

2.830

Water Solubility, LogSw

-3.73

Polar Surface Area

46.055

Acid Dissociation Constant (pKa)

28.84

Base Dissociation Constant (pKb)

7.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

V026-3146 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V026-3146 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-3146?
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What is the minimum amount of V026-3146 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-3146
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-3146
  • 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 V026-3146 available by request