Basic information
- CAS
65009-16-7- Standard SMILES
CN=C(N)NC(=O)Nc1c(C(C)C)cccc1C(C)C.O=C(O)CCC(=O)O- InChIKey
MTUSOHPXFNVCNR-UHFFFAOYSA-N- Molecular formula
- C19H30N4O5
- Average molar mass
- 394.5 g/mol
- Monoisotopic mass
- 394.22162007
Names & identifiers
- Preferred name
- Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-(imino(methylamino)methyl)-, butanedioate (1:1)
- IUPAC
- butanedioic acid;1-[2,6-di(propan-2-yl)phenyl]-3-(N'-methylcarbamimidoyl)urea
Names & synonyms
Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-(imino(methylamino)methyl)-, butanedioate (1:1)65009-16-7DTXSID10215325N-(2,6-Bis(1-methylethyl)phenyl)-N'-methylamidino-urea succinateUrea, 1-(2,6-bis(isopropyl)phenyl)-3-methylamidino-, succinateN-(2,6-Bis(1-methylethyl)phenyl)-N'-(imino(methylamino)methyl)urea butanedioate (1:1)RefChem:387858DTXCID10137816Butanedioic acid--N-[2,6-di(propan-2-yl)phenyl]-N'-(N'-methylcarbamimidoyl)urea (1/1)
Database identifiers
- CAS
65009-16-7- PubChem CID
- 3049554
- DTXSID
DTXSID10215325
Properties
Computed structural properties
- Topological polar surface area
- 154 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 428
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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