N-[(1S,2S)-2-Aminocyclohexyl]-4-methylbenzenesulfonamide - CAS 174291-97-5
Catalog: |
BB013001 |
Product Name: |
N-[(1S,2S)-2-Aminocyclohexyl]-4-methylbenzenesulfonamide |
CAS: |
174291-97-5 |
Synonyms: |
N-[(1S,2S)-2-aminocyclohexyl]-4-methylbenzenesulfonamide; N-[(1S,2S)-2-aminocyclohexyl]-4-methylbenzenesulfonamide |
IUPAC Name: | N-[(1S,2S)-2-aminocyclohexyl]-4-methylbenzenesulfonamide |
Description: | N-[(1S,2S)-2-Aminocyclohexyl]-4-methylbenzenesulfonamide (CAS# 174291-97-5 ) is a useful research chemical. |
Molecular Weight: | 268.38 |
Molecular Formula: | C13H20N2O2S |
Canonical SMILES: | CC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2N |
InChI: | InChI=1S/C13H20N2O2S/c1-10-6-8-11(9-7-10)18(16,17)15-13-5-3-2-4-12(13)14/h6-9,12-13,15H,2-5,14H2,1H3/t12-,13-/m0/s1 |
InChI Key: | VVOFSHARRCJLLA-STQMWFEESA-N |
Melting Point: | 106-110 °C |
Purity: | 97 % |
Storage: | Sealed in dry. Keep in dark place. Keep cold. |
MDL: | MFCD09265104 |
LogP: | 3.71520 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-20200082952-A | Method for producing chiral gamma-lactam compound and metal complex therefor | 20181231 |
WO-2020141734-A1 | Method for preparing chiral gamma-lactam compound and metal complex therefor | 20181231 |
JP-2018090574-A | Pharmaceutical composition containing nitrogen-containing tricyclic derivative | 20161128 |
JP-6689013-B2 | Pharmaceutical composition containing nitrogen-containing tricyclic derivative | 20161128 |
AU-2016271762-A1 | Nitrogen-containing tricyclic derivative having HIV replication inhibitory activity | 20150529 |
Complexity: | 356 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 268.12454906 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 268.12454906 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 80.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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