Basic information
- CAS
30146-60-2- Standard SMILES
Nc1nc(CN2CCc3ccccc3C2)nc(N2CCOCC2)n1- InChIKey
IIAIKQFMKXFAFT-UHFFFAOYSA-N- Molecular formula
- C17H22N6O
- Average molar mass
- 326.4 g/mol
- Monoisotopic mass
- 326.18550935
Names & identifiers
- Preferred name
- Isoquinoline, 1,2,3,4-tetrahydro-2-((4-amino-6-morpholino-s-triazin-2-yl)methyl)-
- IUPAC
- 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
Names & synonyms
AF 6530146-60-2BRN 1168393Isoquinoline, 1,2,3,4-tetrahydro-2-((4-amino-6-morpholino-s-triazin-2-yl)methyl)-DTXSID201842301,2,3,4-Tetrahydro-2-((4-amino-6-morpholino-s-triazin-2-yl)methyl)isoquinolineRefChem:349918DTXCID301067214-[(3,4-Dihydroisoquinolin-2(1H)-yl)methyl]-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
Database identifiers
- CAS
30146-60-2- PubChem CID
- 34836
- DTXSID
DTXSID20184230
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 80.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 405
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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