Basic information
- Standard SMILES
CCN(CC)CCCOc1ccccc1S(=O)(=O)Nc1ccc2c(c1C(=O)O)CCCC2- InChIKey
QFEHYLCTLSRBTJ-UHFFFAOYSA-N- Molecular formula
- C24H32N2O5S
- Average molar mass
- 460.6 g/mol
- Monoisotopic mass
- 460.2031933
Names & identifiers
- Preferred name
- 2-[({2-[3-(Diethylamino)propoxy]phenyl}sulfonyl)amino]-5,6,7,8-tetrahydro-1-naphthalenecarboxylic acid
- IUPAC
- 2-[[2-[3-(diethylamino)propoxy]phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
Names & synonyms
CHEMBL209368SCHEMBL3982222BDBM17550QFEHYLCTLSRBTJ-UHFFFAOYSA-NAnthranilic Acid Sulfonamide, 20a2-({2-[3-(diethylamino)propoxy]benzene}sulfonamido)-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid2-[({2-[3-(diethylamino)propoxy]phenyl}sulfonyl)amino]-5,6,7,8-tetrahydro-1-naphthalenecarboxylic acid
Database identifiers
- PubChem CID
- 11633995
- ChEMBL
CHEMBL209368
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 691
Related reactions
1 records
Compound notes
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