Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)N(C)CC(=O)N(Cc2ccc(-c3ccc(C(N)=O)cc3)cc2)c2ccc(C(=O)OCc3ccccc3)c(OCc3ccccc3)c2)cc1- InChIKey
FQXPIXJKHBUIMH-UHFFFAOYSA-N- Molecular formula
- C45H41N3O7S
- Average molar mass
- 767.9 g/mol
Names & identifiers
- Preferred name
- Benzyl 2-(Benzyloxy)-4-(N-((4'-Carbamoylbiphenyl-4-Yl)Methyl)-2-(N,4-Dimethyl Phenylsulfonamido)Acetamido)Benzoate
- IUPAC
- benzyl 4-[[4-(4-carbamoylphenyl)phenyl]methyl-[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]amino]-2-phenylmethoxybenzoate
Names & synonyms
SCHEMBL10246186FQXPIXJKHBUIMH-UHFFFAOYSA-NBenzyl 2-(Benzyloxy)-4-(N-((4'-Carbamoylbiphenyl-4-Yl)Methyl)-2-(N,4-Dimethyl Phenylsulfonamido)Acetamido)Benzoate
Database identifiers
- PubChem CID
- 68076518
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 16
- Heavy atoms
- 56
- Formal charge
- 0
- Complexity
- 1,350
Related reactions
1 records
Compound notes
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