Basic information
- CAS
179748-10-8- Standard SMILES
N=C(N)c1ccc2[nH]c(-c3ccccc3O)cc2c1- InChIKey
JPGNPKIYCTXJPG-UHFFFAOYSA-N- Molecular formula
- C15H13N3O
- Average molar mass
- 251.28 g/mol
- Monoisotopic mass
- 251.10586205
Names & identifiers
- Preferred name
- 2-(2-hydroxyphenyl)-1H-indole-5-carboximidamide
- IUPAC
- 2-(2-hydroxyphenyl)-1H-indole-5-carboximidamide
Names & synonyms
2-(2-hydroxyphenyl)-1H-indole-5-carboximidamide179748-10-8CRA-8328CHEMBL2848051gi6SCHEMBL4995709BDBM14327DTXSID10274311BDBM50102768PD042549SY376266NS00069136
Show more names
2-{5-[amino(iminiumyl)methyl]-1H-indol-2-yl}benzen-1-olate
Database identifiers
- CAS
179748-10-8- PubChem CID
- 1508
- DTXSID
DTXSID10274311- ChEMBL
CHEMBL284805- Nikkaji
- J1.764.422J
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 85.9 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 346
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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