D727-0265 Screening compound: 7-(3,4-dimethoxyphenyl)-3-phenyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Chemical Structure Depiction of ChemDiv screening compound D727-0265
7-(3,4-dimethoxyphenyl)-3-phenyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-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
D727-0265
Molecular Formula
C18H14N4O3S (C18 H14 N4 O3 S)
Compound Name
7-(3,4-dimethoxyphenyl)-3-phenyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
IUPAC name
7-(34-dimethoxyphenyl)-3-phenyl-4H-[134]thiadiazolo[23-c][124]triazin-4-one
SMILES
COc(ccc(C(SC1=NN=C2c3ccccc3)=NN1C2=O)c1)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
366.4
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.088
Distribution Coefficient, logD
3.084
Water Solubility, LogSw
-3.36
Polar Surface Area
63.086
Acid Dissociation Constant (pKa)
33.29
Base Dissociation Constant (pKb)
5.39
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
11.10
D727-0265 in Drug Discovery
Included in Screening Libraries
Angiogenesis library (14822 compounds)
Anti-Inflammatory Library (24602 compounds)
C-Met Library (15277 compounds)
Regenerative Medicine Focused Library (23016 compounds)
Included in 1.7M Stock Database
- Cancer
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Endocrine
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
- Kinases
- Receptor's ligands
References: we are preparing a list of scientific research reports with D727-0265 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)