Benzenecarboximidamide, 2-hydroxy-3-(1H-imidazol-4-ylmethyl)-N-(1-methylethyl)-, hydrate
Basic information
- CAS
164334-96-7- Standard SMILES
CC(C)N=C(N)c1cccc(Cc2cnc[nH]2)c1O- InChIKey
QOUDMYPZWDOWNS-UHFFFAOYSA-N- Molecular formula
- C14H18N4O
- Average molar mass
- 258.32 g/mol
- Monoisotopic mass
- 258.14806121
Names & identifiers
- Preferred name
- Benzenecarboximidamide, 2-hydroxy-3-(1H-imidazol-4-ylmethyl)-N-(1-methylethyl)-, hydrate
- IUPAC
- 2-hydroxy-3-(1H-imidazol-5-ylmethyl)-N'-propan-2-ylbenzenecarboximidamide
Names & synonyms
Benzenecarboximidamide, 2-hydroxy-3-(1H-imidazol-4-ylmethyl)-N-(1-methylethyl)-, hydrate164334-96-7RefChem:10783882-Hydroxy-3-(1H-imidazol-4-ylmethyl)-N-(1-methylethyl)benzenecarboximidamide hydrateSCHEMBL8088831SCHEMBL8088834QOUDMYPZWDOWNS-UHFFFAOYSA-NL0119322-hydroxy-3-(1H-imidazol-4-ylmethyl)-N-(1-methylethyl)-benzenecarboximidamide
Database identifiers
- CAS
164334-96-7- PubChem CID
- 3074850
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 87.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 319
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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