Y010-0481 Screening compound: ethyl 4-amino-3-[(3-chlorophenyl)carbamoyl]pyrazolo[3,2-c][1,2,4]triazine-8-carboxylate
Chemical Structure Depiction of ChemDiv screening compound Y010-0481
ethyl 4-amino-3-[(3-chlorophenyl)carbamoyl]pyrazolo[3,2-c][1,2,4]triazine-8-carboxylate
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
Y010-0481
Molecular Formula
C15H13ClN6O3 (C15 H13 ClN6 O3)
Compound Name
ethyl 4-amino-3-[(3-chlorophenyl)carbamoyl]pyrazolo[3,2-c][1,2,4]triazine-8-carboxylate
IUPAC name
ethyl 4-amino-3-[(3-chlorophenyl)carbamoyl]pyrazolo[32-c][124]triazine-8-carboxylate
SMILES
CCOC(c1c2nnc(C(Nc3cccc(Cl)c3)=O)c(N)n2nc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
360.76
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
1.927
Distribution Coefficient, logD
1.926
Water Solubility, LogSw
-3.12
Polar Surface Area
97.179
Acid Dissociation Constant (pKa)
10.24
Base Dissociation Constant (pKb)
-0.25
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
13.30
Y010-0481 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
C-Met Library (15277 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Endocrine
- Kinases
- Receptor's ligands
References: we are preparing a list of scientific research reports with Y010-0481 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)