4-(1,3-Benzothiazol-2-yl)-n,n-dimethylaniline - CAS 10205-56-8
Catalog: |
BB073254 |
Product Name: |
4-(1,3-Benzothiazol-2-yl)-n,n-dimethylaniline |
CAS: |
10205-56-8 |
Synonyms: |
4-(1,3-Benzothiazol-2-yl)-N,N-dimethylaniline; Luciferase-IN-1; 4-(Benzo[d]thiazol-2-yl)-N,N-dimethylaniline; 2-(4'-Dimethylaminophenyl)benzothiazole; Benzenamine, 4-(2-benzothiazolyl)-N,N-dimethyl-; (4-Benzothiazol-2-yl-phenyl)-dimethyl-amine; Benzothiazole, 2-(p-(dimethylamino)phenyl)- |
IUPAC Name: | 4-(1,3-benzothiazol-2-yl)-N,N-dimethylaniline |
Molecular Weight: | 254.35 |
Molecular Formula: | C15H14N2S |
Canonical SMILES: | CN(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3S2 |
InChI: | InChI=1S/C15H14N2S/c1-17(2)12-9-7-11(8-10-12)15-16-13-5-3-4-6-14(13)18-15/h3-10H,1-2H3 |
InChI Key: | HYKGLCSXVAAXNC-UHFFFAOYSA-N |
Complexity: | 274 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 254.08776963 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 254.08776963 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 44.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.4 |
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