0927-0009 Screening compound: (2Z,5Z)-5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[(2-chlorophenyl)imino]-1,3-thiazolidin-4-one
Chemical Structure Depiction of ChemDiv screening compound 0927-0009
(2Z,5Z)-5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[(2-chlorophenyl)imino]-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
0927-0009
Molecular Formula
C17H11ClN2O3S (C17 H11 ClN2 O3 S)
Compound Name
(2Z,5Z)-5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[(2-chlorophenyl)imino]-1,3-thiazolidin-4-one
IUPAC name
(2Z5Z)-5-[(2H-13-benzodioxol-5-yl)methylidene]-2-[(2-chlorophenyl)imino]-13-thiazolidin-4-one
SMILES
O=C(/C(/S1)=C/c(cc2)cc3c2OCO3)N/C1=N/c(cccc1)c1Cl
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
358.8
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.697
Distribution Coefficient, logD
3.695
Water Solubility, LogSw
-4.28
Polar Surface Area
49.570
Acid Dissociation Constant (pKa)
9.66
Base Dissociation Constant (pKb)
0.79
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
5.90
0927-0009 in Drug Discovery
Included in Screening Libraries
Antimitotic Tubulin Library (17355 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Agro
References: we are preparing a list of scientific research reports with 0927-0009 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)