| CAS Number | 1187075-34-8 |
| Catalog Number | AG008ST8 |
| Chemical Name | RAS-2410 hydrochloride |
| IUPAC Name | (E)-3-[1-[4-[(dimethylamino)methyl]phenyl]sulfonylpyrrol-3-yl]-N-hydroxyprop-2-enamide;hydrochloride |
| InChI | InChI=1S/C16H19N3O4S.ClH/c1-18(2)11-13-3-6-15(7-4-13)24(22,23)19-10-9-14(12-19)5-8-16(20)17-21;/h3-10,12,21H,11H2,1-2H3,(H,17,20);1H/b8-5+; |
| InChI Key | BVXPKDRKHXARHY-HAAWTFQLSA-N |
| MDL Number | MFCD26142920 |
| Molecular Formula | C16H20ClN3O4S |
| Molecular Weight | 385.8657 |
| SMILES | Cl.CN(C)CC1=CC=C(C=C1)S(=O)(=O)N1C=C(C=C1)/C=C/C(=O)NO |
| Synonyms | Resminostat (hydrochloride),
1187075-34-8,
Resminostat hydrochloride,
4SC-201 hydrochloride,
RAS2410 hydrochloride,
RAS-2410 hydrochloride,
SCHEMBL1887874,
SCHEMBL1887878,
BVXPKDRKHXARHY-HAAWTFQLSA-N,
HY-14718A,
AKOS030526299,
Resminostat hydrochloride (4SC-201),
CS-1522,
QC-10458,
W-6127,
RAS2410 hydrochloride;4SC-201 hydrochloride;RAS 2410 hydrochloride;RAS-2410 hydrochloride,
(E)-3-[1-(4-dimethylaminomethyl-benzenesulfonyl)-1H-pyrrol-3-yl]-N-hydroxy-acrylamide hydrochloride,
A15220,
864814-88-0,
|
| Complexity | 548 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 385.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 385.863g/mol |
| Monoisotopic Mass | 385.086g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 100A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number