2-[2-methyl-5-(naphthalen-2-ylcarbamoyl)thiophen-3-yl]acetic Acid
Basic information
- CAS
400866-43-5- Standard SMILES
Cc1sc(C(=O)Nc2ccc3ccccc3c2)cc1CC(=O)O- InChIKey
VYXMAWNVLKCEAC-UHFFFAOYSA-N- Molecular formula
- C18H15NO3S
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.07726451
Names & identifiers
- Preferred name
- 2-[2-methyl-5-(naphthalen-2-ylcarbamoyl)thiophen-3-yl]acetic Acid
- IUPAC
- 2-[2-methyl-5-(naphthalen-2-ylcarbamoyl)thiophen-3-yl]acetic acid
- English name
- (2-Methyl-5-((2-naphthylamino)carbonyl)-3-thienyl)acetic acid
- Molecular weight
- 0
Names & synonyms
2-[2-methyl-5-(naphthalen-2-ylcarbamoyl)thiophen-3-yl]acetic Acid{2-methyl-5-[(2-naphthylamino)carbonyl]-3-thienyl}acetic acid(2-METHYL-5-((2-NAPHTHYLAMINO)CARBONYL)-3-THIENYL)ACETIC ACIDMLS000862506CHEMBL1598707HMS2652D22AKOS024325379SMR000300547ST50447576SR-01000286449SR-01000286449-1
Database identifiers
- CAS
400866-43-5- PubChem CID
- 854084
- ChEMBL
CHEMBL1598707- EC Number
- 143-899-6
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 94.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 456
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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