| CAS Number | 1011301-29-3 |
| Catalog Number | AG008TJX |
| Chemical Name | Tenovin 6 (Hydrochloride) |
| IUPAC Name | 4-tert-butyl-N-[[4-[5-(dimethylamino)pentanoylamino]phenyl]carbamothioyl]benzamide;hydrochloride |
| InChI | InChI=1S/C25H34N4O2S.ClH/c1-25(2,3)19-11-9-18(10-12-19)23(31)28-24(32)27-21-15-13-20(14-16-21)26-22(30)8-6-7-17-29(4)5;/h9-16H,6-8,17H2,1-5H3,(H,26,30)(H2,27,28,31,32);1H |
| InChI Key | UBNCTIDXQDCEPI-UHFFFAOYSA-N |
| MDL Number | MFCD28099814 |
| Molecular Formula | C25H35ClN4O2S |
| Molecular Weight | 491.0890 |
| SMILES | O=C(NC(NC1=CC=C(NC(CCCCN(C)C)=O)C=C1)=S)C2=CC=C(C(C)(C)C)C=C2.Cl |
| Synonyms | Tenovin 6 (Hydrochloride),
Tenovin 6 Hydrochloride,
1011301-29-3,
CHEMBL1945130,
Tenovin6 hydrochloride,
Tenovin-6 Hydrochloride,
C25H34N4O2S.ClH,
SCHEMBL907346,
BCP18122,
2167AH,
HY-15510B,
s4900,
AKOS030526197,
CS-2321,
4-(Tert-butyl)-N-((4-(5-(dimethylamino)pentanamido)phenyl)carbamothioyl)benzamide hydrochloride,
4-tert-butyl-N-[[4-[5-(dimethylamino)pentanoylamino]phenyl]carbamothioyl]benzamide;hydrochloride,
Tenovin-6,
1011557-82-6,
|
| Complexity | 616 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 490.217g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 33 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 491.091g/mol |
| Monoisotopic Mass | 490.217g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 106A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number