Basic information
- CAS
320415-97-2- Standard SMILES
Clc1ccc(-c2ccnc3nc(N4CCOCC4)nn23)c(Cl)c1- InChIKey
CHYUNTXRDGRNQZ-UHFFFAOYSA-N- Molecular formula
- C15H13Cl2N5O
- Average molar mass
- 350.2 g/mol
- Monoisotopic mass
- 349.0497154
Names & identifiers
- Preferred name
- 4-[7-(2,4-Dichlorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]morpholine
- IUPAC
- 4-[7-(2,4-dichlorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]morpholine
- English name
- 7-(2,4-DICHLOROPHENYL)-2-MORPHOLINO[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE
- Molecular formula
- C15H13Cl2N5O
- Molecular weight
- 350.2
Names & synonyms
4-[7-(2,4-dichlorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]morpholine320415-97-27-(2,4-dichlorophenyl)-2-morpholino[1,2,4]triazolo[1,5-a]pyrimidineCDS1_001190Bionet1_000214Oprea1_094260MLS000694818DivK1c_002230CHEMBL1904926HMS568G16HMS2755A12AKOS005081866
Show more names
[1,2,4]Triazolo[1,5-a]pyrimidine, 7-(2,4-dichlorophenyl)-2-(4-morpholinyl)-
SMR0003331311D-013
Database identifiers
- CAS
320415-97-2- PubChem CID
- 1476926
- ChEMBL
CHEMBL1904926
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 411
Physicochemical properties
- Density
- 1.58 · 1.58±0.1 g/cm3(Predicted)
- pka
- 3.21 · 3.21±0.30(Predicted)
Chemistry & industry
Suppliers3 total
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…