V001-9925 Screening compound: N-(3-{4-oxo-3-[4-(propan-2-yl)phenyl]-1,3-thiazolidin-2-yl}phenyl)decanamide
Chemical Structure Depiction of ChemDiv screening compound V001-9925
N-(3-{4-oxo-3-[4-(propan-2-yl)phenyl]-1,3-thiazolidin-2-yl}phenyl)decanamide
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
V001-9925
Molecular Formula
C28H38N2O2S (C28 H38 N2 O2 S)
Compound Name
N-(3-{4-oxo-3-[4-(propan-2-yl)phenyl]-1,3-thiazolidin-2-yl}phenyl)decanamide
IUPAC name
N-(3-{4-oxo-3-[4-(propan-2-yl)phenyl]-13-thiazolidin-2-yl}phenyl)decanamide
SMILES
CCCCCCCCCC(Nc1cccc(C(N2c3ccc(C(C)C)cc3)SCC2=O)c1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
466.69
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
13.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
7.744
Distribution Coefficient, logD
7.744
Water Solubility, LogSw
-5.66
Polar Surface Area
39.282
Acid Dissociation Constant (pKa)
12.17
Base Dissociation Constant (pKb)
2.80
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
50.00
V001-9925 in Drug Discovery
Included in Screening Libraries
Eccentric PPI Library (11937 compounds)
Protein-Protein Interaction Library (218420 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with V001-9925 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)