Basic information
- CAS
95-22-7- Standard SMILES
Cc1ccc2nc(-c3ccc4nc(-c5ccc(N)cc5)sc4c3)sc2c1- InChIKey
YLEIZZYNXHCGKG-UHFFFAOYSA-N- Molecular formula
- C21H15N3S2
- Average molar mass
- 373.5 g/mol
- Monoisotopic mass
- 373.07073984
Names & identifiers
- Preferred name
- Benzenamine, 4-(6-methyl[2,6'-bibenzothiazol]-2'-yl)-
- IUPAC
- 4-[6-(6-methyl-1,3-benzothiazol-2-yl)-1,3-benzothiazol-2-yl]aniline
Names & synonyms
Benzenamine, 4-(6-methyl[2,6'-bibenzothiazol]-2'-yl)-Benzenamine, 4-(6-methyl(2,6'-bibenzothiazol)-2'-yl)-EINECS 202-400-2NSC 242018DTXSID00591182,6'-Bibenzothiazole, 2'-(p-aminophenyl)-6-methyl-RefChem:561859DTXCID30489482,6'-Bibenzothiazole, 2'-(p-aminophenyl)-6-methyl-(8CI)95-22-74-[6-(6-methyl-1,3-benzothiazol-2-yl)-1,3-benzothiazol-2-yl]anilineNSC242018
Show more names
4-(6'-Methyl-2',6-bibenzothiazol-2-yl)anilineSCHEMBL2628249YLEIZZYNXHCGKG-UHFFFAOYSA-N2, 2'-(p-aminophenyl)-6-methyl-AKOS026745465NSC-242018Benzenamine,6'-bibenzothiazol]-2'-yl)-NS00040440
Database identifiers
- CAS
95-22-7- PubChem CID
- 66764
- DTXSID
DTXSID0059118- EC Number
- 202-400-2
- Nikkaji
- J182.111C
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 496
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenamine, 4-(6-methyl[2,6'-bibenzothiazol]-2'-yl)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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