3277-0202 Screening compound: 2-[5-(4-fluorophenyl)-2H-1,2,3,4-tetrazol-2-yl]-N'-[(E)-{3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene]acetohydrazide
Chemical Structure Depiction of ChemDiv screening compound 3277-0202
2-[5-(4-fluorophenyl)-2H-1,2,3,4-tetrazol-2-yl]-N'-[(E)-{3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene]acetohydrazide
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
3277-0202
Molecular Formula
C24H21FN10O4 (C24 H21 FN10 O4)
Compound Name
2-[5-(4-fluorophenyl)-2H-1,2,3,4-tetrazol-2-yl]-N'-[(E)-{3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene]acetohydrazide
IUPAC name
2-[5-(4-fluorophenyl)-2H-1234-tetrazol-2-yl]-N'-[(E)-{3-[(137-trimethyl-26-dioxo-2367-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene]acetohydrazide
SMILES
Cn1c(Oc2cccc(/C=N/NC(Cn3nnc(-c(cc4)ccc4F)n3)=O)c2)nc(N(C)C(N2C)=O)c1C2=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
532.49
Hydrogen Bond Acceptors Count
12.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
14
Partition Coefficient, logP
2.517
Distribution Coefficient, logD
2.516
Water Solubility, LogSw
-2.96
Polar Surface Area
124.311
Acid Dissociation Constant (pKa)
11.28
Base Dissociation Constant (pKb)
2.32
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
16.70
References: we are preparing a list of scientific research reports with 3277-0202 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)