1,3-Propanediol, 2-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-1-phenyl-
Basic information
- CAS
127374-86-1- Standard SMILES
CCCc1nc(NC(CO)C(O)c2ccccc2)nc(N2CCOCC2)n1- InChIKey
GWVLAYVFOMAEKK-UHFFFAOYSA-N- Molecular formula
- C19H27N5O3
- Average molar mass
- 373.4 g/mol
- Monoisotopic mass
- 373.21138974
Names & identifiers
- Preferred name
- 1,3-Propanediol, 2-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-1-phenyl-
- IUPAC
- 2-[(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)amino]-1-phenylpropane-1,3-diol
Names & synonyms
2-((4-(4-Morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-1-phenyl-1,3-propanediol127374-86-11,3-Propanediol, 2-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-1-phenyl-RefChem:219573DTXSID309258732-{[6-(Morpholin-4-yl)-4-propyl-1,3,5-triazin-2(1H)-ylidene]amino}-1-phenylpropane-1,3-diol
Database identifiers
- CAS
127374-86-1- PubChem CID
- 3080128
- DTXSID
DTXSID30925873
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 418
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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