Benzamide, N-(3-((4-((2,3-dihydroxybenzoyl)amino)butyl)amino)propyl)-2,3-dihydroxy-, hydrochloride
Basic information
- CAS
73038-10-5- Standard SMILES
Cl.O=C(NCCCCNCCCNC(=O)c1cccc(O)c1O)c1cccc(O)c1O- InChIKey
NAZMCZJIPMDEED-UHFFFAOYSA-N- Molecular formula
- C21H28ClN3O6
- Average molar mass
- 453.9 g/mol
- Monoisotopic mass
- 453.1666633
Names & identifiers
- Preferred name
- Benzamide, N-(3-((4-((2,3-dihydroxybenzoyl)amino)butyl)amino)propyl)-2,3-dihydroxy-, hydrochloride
- IUPAC
- N-[4-[3-[(2,3-dihydroxybenzoyl)amino]propylamino]butyl]-2,3-dihydroxybenzamide;hydrochloride
Names & synonyms
74427-44-4RefChem:1078068Benzamide, N-(3-((4-((2,3-dihydroxybenzoyl)amino)butyl)amino)propyl)-2,3-dihydroxy-, hydrochloride73038-10-5Benzamide, N-(3-((4-((2,3-dihydroxybenzoyl)amino)butyl)amino)propyl)-2,3-dihydroxy-, monohydrochlorideN(sup 1),N(sup 8)-Bis(2,3-dihydroxybenzoyl)spermidine monohydrochlorideN(sup 1),N(sup 8)-Bis(2,3-dihydroxybenzoyl)spermidine hydrochloride hydrate2,3-Dihydroxy-N-(3-((4-((2,3-dihydroxybenzoyl)amino)butyl)amino)propyl)benzamide HCl H2ON-(3-((4-((2,3-Dihydroxybenzoyl)amino)butyl)amino)propyl)-2,3-dihydroxybenzamide HClBenzamide, 2,3-dihydroxy-N-(3-((4-((2,3-dihydroxybenzoyl)amino)butyl)amino)propyl)-, hydrochloride, hydrateCHEMBL1202418DTXSID50993812
Show more names
N-[4-[3-[(2,3-dihydroxybenzoyl)amino]propylamino]butyl]-2,3-dihydroxybenzamide hydrochlorideDB-244125N-{3-[(4-{[(2,3-Dihydroxyphenyl)(hydroxy)methylidene]amino}butyl)amino]propyl}-2,3-dihydroxybenzene-1-carboximidic acid--hydrogen chloride (1/1)
Properties
Computed structural properties
- Topological polar surface area
- 151 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 535
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