G357-1273 Screening compound: {2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(2-phenoxyacetamido)benzoate
Chemical Structure Depiction of ChemDiv screening compound G357-1273
{2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(2-phenoxyacetamido)benzoate
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
G357-1273
Molecular Formula
C24H20N4O5S (C24 H20 N4 O5 S)
Compound Name
{2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(2-phenoxyacetamido)benzoate
IUPAC name
{2-cyclopropyl-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl}methyl 4-(2-phenoxyacetamido)benzoate
SMILES
O=C(COc1ccccc1)Nc(cc1)ccc1C(OCC(N=C1SC(C2CC2)=NN11)=CC1=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
476.51
Hydrogen Bond Acceptors Count
11.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
3.987
Distribution Coefficient, logD
3.979
Water Solubility, LogSw
-4.36
Polar Surface Area
90.028
Acid Dissociation Constant (pKa)
10.98
Base Dissociation Constant (pKb)
5.61
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.80
G357-1273 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
References: we are preparing a list of scientific research reports with G357-1273 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)