D715-1148 Screening compound: 3-{7-[(2-chlorophenyl)methoxy]-4,8-dimethyl-2-oxo-2H-chromen-3-yl}propanoic acid
Chemical Structure Depiction of ChemDiv screening compound D715-1148
3-{7-[(2-chlorophenyl)methoxy]-4,8-dimethyl-2-oxo-2H-chromen-3-yl}propanoic acid
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
D715-1148
Molecular Formula
C21H19ClO5 (C21 H19 ClO5)
Compound Name
3-{7-[(2-chlorophenyl)methoxy]-4,8-dimethyl-2-oxo-2H-chromen-3-yl}propanoic acid
IUPAC name
3-{7-[(2-chlorophenyl)methoxy]-48-dimethyl-2-oxo-2H-chromen-3-yl}propanoic acid
SMILES
Cc(c(O1)c(cc2)C(C)=C(CCC(O)=O)C1=O)c2OCc(cccc1)c1Cl
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
386.83
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.413
Distribution Coefficient, logD
1.917
Water Solubility, LogSw
-4.26
Polar Surface Area
56.542
Acid Dissociation Constant (pKa)
4.91
Base Dissociation Constant (pKb)
0.00
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
23.80
D715-1148 in Drug Discovery
Included in Screening Libraries
Antiviral Annotated Library (21441 compounds)
Human Phosphatases Annotated Library (206 compounds)
Human Proteases Annotated Library (2868 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Epigenetic
- Phosphatases
References: we are preparing a list of scientific research reports with D715-1148 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)