2-[4-[5-[4-(Diaminomethylideneamino)-2-methylphenyl]furan-2-yl]-3-methylphenyl]guanidine
Basic information
- CAS
423165-10-0- Standard SMILES
Cc1cc(N=C(N)N)ccc1-c1ccc(-c2ccc(N=C(N)N)cc2C)o1- InChIKey
KOFVLPOSCTWTOE-UHFFFAOYSA-N- Molecular formula
- C20H22N6O
- Average molar mass
- 362.4 g/mol
- Monoisotopic mass
- 362.18550935
Names & identifiers
- Preferred name
- 2-[4-[5-[4-(Diaminomethylideneamino)-2-methylphenyl]furan-2-yl]-3-methylphenyl]guanidine
- IUPAC
- 2-[4-[5-[4-(diaminomethylideneamino)-2-methylphenyl]furan-2-yl]-3-methylphenyl]guanidine
Names & synonyms
423165-10-01,1'-(Furan-2,5-diylbis(3-methyl-4,1-phenylene))diguanidine2-[4-[5-[4-(diaminomethylideneamino)-2-methylphenyl]furan-2-yl]-3-methylphenyl]guanidineCHEMBL298369SCHEMBL6748327DTXSID20333180N'',N'''-[Furan-2,5-diylbis(3-methyl-4,1-phenylene)]diguanidine1-[4-[5-(4-guanidino-2-methyl-phenyl)-2-furyl]-3-methyl-phenyl]guanidine(4-{5-[4-(Amidinoamino)-2-methylphenyl](2-furyl)}-3-methylphenyl)aminocarboxamidine
Database identifiers
- CAS
423165-10-0- PubChem CID
- 487974
- DTXSID
DTXSID20333180- ChEMBL
CHEMBL298369- Nikkaji
- J1.562.765D
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 509
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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