Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-
Basic information
- CAS
35972-60-2- Standard SMILES
NC(N)=NC(=O)Nc1ccc(S(=O)(=O)c2ccc(Br)cc2)cc1- InChIKey
PTLQKHQTJCTUCI-UHFFFAOYSA-N- Molecular formula
- C14H13BrN4O3S
- Average molar mass
- 397.25 g/mol
- Monoisotopic mass
- 395.98917
Names & identifiers
- Preferred name
- Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-
- IUPAC
- 1-[4-(4-bromophenyl)sulfonylphenyl]-3-(diaminomethylidene)urea
Names & synonyms
((p-Bromophenyl)sulfonyl)phenylcarbamoylguanidine4-Bromophenyl 4'-(guanidinoformamido)phenyl sulfoneBRN 300663235972-60-2Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-Sulfone, 4-bromophenyl 4'-(guanidinoformamido)phenylUrea, 1-amidino-3-(p-((p-bromophenyl)sulfonyl)phenyl)-RefChem:346687DTXSID50957398N-[4-(4-Bromobenzene-1-sulfonyl)phenyl]-N'-carbamimidoylcarbamimidic acid
Database identifiers
- CAS
35972-60-2- PubChem CID
- 215638
- DTXSID
DTXSID50957398- Nikkaji
- J78.431A
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 541
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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