Dimidium
Basic information
- CAS
20566-69-2- Standard SMILES
C[n+]1c(-c2ccccc2)c2cc(N)ccc2c2ccc(N)cc21- InChIKey
MRYUEHRAIMRPNB-UHFFFAOYSA-O- Molecular formula
- C20H18N3+
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.15007259
Overview
RN given refers to parent cpd
Names & identifiers
- Preferred name
- Dimidium
- IUPAC
- 5-methyl-6-phenylphenanthridin-5-ium-3,8-diamine
- English name
- dimidium
- Molecular weight
- 0
Names & synonyms
Dimidium20566-69-2RefChem:1344053,8-Diamino-5-methyl-6-phenylphenanthridinium5-methyl-6-phenylphenanthridin-5-ium-3,8-diamineDimidium (bromide)Phenanthridinium, 3,8-diamino-5-methyl-6-phenyl-BDBM183,8-Diamino-5-methyl-6-phenyl-phenanthridiniumcid_68207CHEMBL344648SCHEMBL2014260
Show more names
3,8-Diamino-5-methyl-6-phenylphenanthridin-5-ium
NCGC00247021-01NS000154055-methyl-6-phenyl-phenanthridin-5-ium-3,8-diamine(3-amino-5-methyl-6-phenyl-phenanthridin-5-ium-8-yl)amine;bromide
Database identifiers
- CAS
20566-69-2- PubChem CID
- 68208
- ChEMBL
CHEMBL344648- Nikkaji
- J16.805J
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 55.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 1
- Complexity
- 406
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Related reactions
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Compound notes
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