2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-((2-naphthalenylsulfonyl)amino)cyclohexyl)amino)-9,10-dioxo-
Basic information
- CAS
83027-33-2- Standard SMILES
Nc1c(S(=O)(=O)O)cc(NC2CCC(NS(=O)(=O)c3ccc4ccccc4c3)CC2)c2c1C(=O)c1ccccc1C2=O- InChIKey
YKVQXEUHVDKZAG-UHFFFAOYSA-N- Molecular formula
- C30H27N3O7S2
- Average molar mass
- 605.7 g/mol
- Monoisotopic mass
- 605.12904256
Names & identifiers
- Preferred name
- 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-((2-naphthalenylsulfonyl)amino)cyclohexyl)amino)-9,10-dioxo-
- IUPAC
- 1-amino-4-[[4-(naphthalen-2-ylsulfonylamino)cyclohexyl]amino]-9,10-dioxoanthracene-2-sulfonic acid
- English name
- 1-amino-9,10-dihydro-4-[[4-[(2-naphthylsulphonyl)amino]cyclohexyl]amino]-9,10-dioxoanthracene-2-sulphonic acid
- Molecular formula
- C30H27N3O7S2
- Molecular weight
- 605.68128
Names & synonyms
2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-((2-naphthalenylsulfonyl)amino)cyclohexyl)amino)-9,10-dioxo-2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[[4-[(2-naphthalenylsulfonyl)amino]cyclohexyl]amino]-9,10-dioxo-RefChem:46531583027-33-2EINECS 280-135-11-Amino-9,10-dihydro-4-((4-((2-naphthylsulphonyl)amino)cyclohexyl)amino)-9,10-dioxoanthracene-2-sulphonic acidDTXSID80868160YKVQXEUHVDKZAG-UHFFFAOYSA-N1-AMINO-4-{[4-(NAPHTHALENE-2-SULFONAMIDO)CYCLOHEXYL]AMINO}-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-SULFONIC ACIDNS000580591-Amino-4-({4-[(naphthalene-2-sulfonyl)amino]cyclohexyl}amino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid1-amino-9,10-dihydro-4-[[4-[(2-naphthylsulphonyl)amino]cyclohexyl]amino]-9,10-dioxoanthracene-2-sulphonic acid
Show more names
1-Amino-9,10-dihydro-4-[[4-[(2-naphthalenylsulfonyl)amino]cyclohexyl]amino]-9,10-dioxo-2-anthracenesulfonic acid2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[[ 4-[(2-naphthalenylsulfonyl)amino]cyclohexyl]amino ]-9,10-dioxo-
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 189 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 1,240
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[[4-[(2-naphthalenylsulfonyl)amino]cyclohexyl]amino]-9,10-dioxo-
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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