7,8,15,16,17,18-Hexahydrodibenzo(e,m)(1,4,8,11)tetraazacyclotetradecine
Basic information
- CAS
33419-89-5- Standard SMILES
C1=NCCN=Cc2ccccc2NCCNc2ccccc21- InChIKey
VEWUWPWFOFCRJF-UHFFFAOYSA-N- Molecular formula
- C18H20N4
- Average molar mass
- 292.4 g/mol
- Monoisotopic mass
- 292.16879665
Names & identifiers
- Preferred name
- 7,8,15,16,17,18-Hexahydrodibenzo(e,m)(1,4,8,11)tetraazacyclotetradecine
- IUPAC
- 2,5,13,16-tetrazatricyclo[16.4.0.06,11]docosa-1(22),6,8,10,12,16,18,20-octaene
Names & synonyms
33419-89-5N6X3CB2ZUB7,8,15,16,17,18-Hexahydrodibenzo(e,m)(1,4,8,11)tetraazacyclotetradecineUNII-N6X3CB2ZUBNSC307138NSC 307138NSC-3071387,8,15,16,17,18-Hexahydrodibenzo[e,m][1,4,8,11]tetraazacyclotetradecineDIBENZO(E,M)(1,4,8,11)TETRAAZACYCLOTETRADECINE, 7,8,15,16,17,18-HEXAHYDRO-
Database identifiers
- CAS
33419-89-5- PubChem CID
- 328508
- UNII
- N6X3CB2ZUB
- Nikkaji
- J1.117.191E
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 48.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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