Basic information
- CAS
5592-64-3- Standard SMILES
CN(C)S(=O)(=O)c1ccc(Sc2ccccc2Br)c(N)c1- InChIKey
YQMIXRUAVHGKTO-UHFFFAOYSA-N- Molecular formula
- C14H15BrN2O2S2
- Average molar mass
- 387.3 g/mol
- Monoisotopic mass
- 385.97583
Names & identifiers
- Preferred name
- 3-Amino-4-((2-bromophenyl)thio)-N,N-dimethylbenzenesulphonamide
- IUPAC
- 3-amino-4-(2-bromophenyl)sulfanyl-N,N-dimethylbenzenesulfonamide
- English name
- 3-Amino-4-[(bromophenyl)thio]-n,n, dimethyl-benzenesulfonamide
- Molecular formula
- C14H15BrN2O2S2
- Molecular weight
- 387.32
Names & synonyms
5592-64-33-Amino-4-((2-bromophenyl)thio)-N,N-dimethylbenzenesulfonamide3-Amino-4-((2-bromophenyl)thio)-N,N-dimethylbenzenesulphonamide3-amino-4-(2-bromophenyl)sulfanyl-N,N-dimethylbenzenesulfonamideEINECS 227-004-7SCHEMBL11090117DTXSID20971344YQMIXRUAVHGKTO-UHFFFAOYSA-N3-amino-4-[(2-bromophenyl)sulfanyl]-N,N-dimethylbenzene-1-sulfonamideAKOS009375530AC-12857NS00043719
Show more names
2-(o-Bromophenylthio)-5-dimethylaminosulfonylaniline2-BROMO-2'-AMINO-4'-((DIMETHYLAMINO)SULFONYL)DIPHENYL SULFIDE3-Amino-4-[(bromophenyl)thio]-n,n, dimethyl-benzenesulfonamide3-amino-4-[(2-bromophenyl)thio]-N,N-dimethylbenzenesulphonamide4-methoxy-2-[4-(3,3,3-triphenylpropyl)-1-piperazinyl]pyrimidineBenzenesulfonamide, 3-amino-4-[(2-bromophenyl)thio]-N,N-dimethyl-3-azanyl-4-(2-bromophenyl)sulfanyl-N,N-dimethyl-benzenesulfonamide3-AMINO-4-[(2''-BROMOPHENYL)THIO]-N,N, DIMETHYL-BENZENESULFONAMIDE
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 97.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 439
Physicochemical properties
- Melting point
- 143 · 143-144 °C
- Boiling point
- 489.7 · 489.7±55.0 °C(Predicted)
- Density
- 1.62 · 1.62±0.1 g/cm3(Predicted)
- pka
- 1.69 · 1.69±0.11(Predicted)
Chemistry & industry
Suppliers3 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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