Basic information
- CAS
4751-88-6- Standard SMILES
CCN(CC)C(=O)c1ccc(NC(=O)N=C(N)N)cc1.Cl- InChIKey
IRJAVBHIJZEKJI-UHFFFAOYSA-N- Molecular formula
- C13H20ClN5O2
- Average molar mass
- 313.78 g/mol
- Monoisotopic mass
- 313.1305526
Names & identifiers
- Preferred name
- Urea, 1-amidino-3-(p-(diethylcarbamoyl)phenyl)-, monohydrochloride
- IUPAC
- 4-(diaminomethylidenecarbamoylamino)-N,N-diethylbenzamide;hydrochloride
Names & synonyms
Urea, 1-amidino-3-(p-(diethylcarbamoyl)phenyl)-, monohydrochloride4751-88-61-Amidino-3-(p-(diethylcarbamoyl)phenyl)urea monohydrochlorideDTXSID10197177RefChem:387574DTXCID201196684-{[(Diaminomethylidene)carbamoyl]amino}-N,N-diethylbenzamide--hydrogen chloride (1/1)
Database identifiers
- CAS
4751-88-6- PubChem CID
- 199684
- DTXSID
DTXSID10197177
Properties
Computed structural properties
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 367
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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