H025-3253 Screening compound: 2-[5-amino-2-(2-furyl)-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-8-yl]acetic acid
Chemical Structure Depiction of ChemDiv screening compound H025-3253
2-[5-amino-2-(2-furyl)-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-8-yl]acetic 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
H025-3253
Molecular Formula
C12H9N7O3 (C12 H9 N7 O3)
Compound Name
2-[5-amino-2-(2-furyl)-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-8-yl]acetic acid
IUPAC name
2-[7-amino-4-(furan-2-yl)-35681011-hexaazatricyclo[7.3.0.0^{26}]dodeca-1(12)2479-pentaen-11-yl]acetic acid
SMILES
Nc1nc2nn(CC(O)=O)cc2c2nc(-c3ccco3)nn12
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
299.25
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
-1.009
Distribution Coefficient, logD
-4.886
Water Solubility, LogSw
-1.11
Polar Surface Area
103.090
Acid Dissociation Constant (pKa)
3.52
Base Dissociation Constant (pKb)
6.08
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
8.33
H025-3253 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with H025-3253 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)