3-Amino-4-bromo-N-cyclohexylbenzamide - CAS 1177210-71-7
Catalog: |
BB075084 |
Product Name: |
3-Amino-4-bromo-N-cyclohexylbenzamide |
CAS: |
1177210-71-7 |
Synonyms: |
3-amino-4-bromo-N-cyclohexylbenzamide |
IUPAC Name: | 3-amino-4-bromo-N-cyclohexylbenzamide |
Description: | 3-Amino-4-bromo-N-cyclohexylbenzamide |
Molecular Weight: | 297.19 |
Molecular Formula: | C13H17BrN2O |
Canonical SMILES: | C1CCC(CC1)NC(=O)C2=CC(=C(C=C2)Br)N |
InChI: | InChI=1S/C13H17BrN2O/c14-11-7-6-9(8-12(11)15)13(17)16-10-4-2-1-3-5-10/h6-8,10H,1-5,15H2,(H,16,17) |
InChI Key: | LSULDEJNIWVXIS-UHFFFAOYSA-N |
Complexity: | 266 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 296.05243 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 296.05243 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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