3-((4-(Cyclohexylamino)-9,10-dihydro-9,10-dioxoanthryl)amino)-N-phenylpropionamide
Basic information
- CAS
24464-64-0- Standard SMILES
O=C(CCNc1ccc(NC2CCCCC2)c2c1C(=O)c1ccccc1C2=O)Nc1ccccc1- InChIKey
BSGWMUMCNMCWCW-UHFFFAOYSA-N- Molecular formula
- C29H29N3O3
- Average molar mass
- 467.6 g/mol
- Monoisotopic mass
- 467.2208918
Names & identifiers
- Preferred name
- 3-((4-(Cyclohexylamino)-9,10-dihydro-9,10-dioxoanthryl)amino)-N-phenylpropionamide
- IUPAC
- 3-[[4-(cyclohexylamino)-9,10-dioxoanthracen-1-yl]amino]-N-phenylpropanamide
- English name
- 3-[[4-(cyclohexylamino)-9,10-dihydro-9,10-dioxoanthryl]amino]-N-phenylpropionamide
- Molecular formula
- C29H29N3O3
- Molecular weight
- 467.56
Names & synonyms
24464-64-03-((4-(Cyclohexylamino)-9,10-dihydro-9,10-dioxoanthryl)amino)-N-phenylpropionamideEINECS 246-275-2DTXSID00179225BSGWMUMCNMCWCW-UHFFFAOYSA-NNS00027669N~3~-[4-(Cyclohexylamino)-9,10-dioxo-9,10-dihydroanthracen-1-yl]-N-phenyl-beta-alaninamide3-[[4-(cyclohexylamino)-9,10-dihydro-9,10-dioxoanthryl]amino]-N-phenylpropionamide3-[[[4-(Cyclohexylamino)-9,10-dihydro-9,10-dioxoanthracen]-1-yl]amino]-N-phenylpropanamidePropanamide, 3-[[4-(cyclohexylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]amino]-N-phenyl-
Database identifiers
- CAS
24464-64-0- PubChem CID
- 90515
- DTXSID
DTXSID00179225- EC Number
- 246-275-2
- Nikkaji
- J287.262E
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 87.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 758
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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