Guanidine, ((p-bromophenyl)sulfonyl)phenylamidino-
Basic information
- CAS
35972-55-5- Standard SMILES
N=C(N)N(C(=N)N)c1ccc(S(=O)(=O)c2ccc(Br)cc2)cc1- InChIKey
BXOVPYHGUNSOMF-UHFFFAOYSA-N- Molecular formula
- C14H14BrN5O2S
- Average molar mass
- 396.26 g/mol
- Monoisotopic mass
- 395.00516
Names & identifiers
- Preferred name
- Guanidine, ((p-bromophenyl)sulfonyl)phenylamidino-
- IUPAC
- 1-[4-(4-bromophenyl)sulfonylphenyl]-1-carbamimidoylguanidine
Names & synonyms
((p-Bromophenyl)sulfonyl)phenylamidinoguanidineBRN 30066314-Bromophenyl 4'-(guanidinoformimidoylamino)phenyl sulfoneGuanidine, ((p-bromophenyl)sulfonyl)phenylamidino-Biguanide, 1-(p-((p-bromophenyl)sulfonyl)phenyl)-35972-55-5Sulfone, 4-bromophenyl 4'-(guanidinoformimidoylamino)phenylRefChem:346686DTXSID90957397N-[4-(4-Bromobenzene-1-sulfonyl)phenyl]triimidodicarbonic diamide
Database identifiers
- CAS
35972-55-5- PubChem CID
- 215635
- DTXSID
DTXSID90957397
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 532
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Compound notes
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