| CAS Number | 221264-43-3 |
| Catalog Number | AG00C2BR(AGN-PC-0WBMNM) |
| Chemical Name | 4-(2-(Dipropylamino)ethyl)-3-propylideneindolin-2-one hydrochloride |
| IUPAC Name | (3Z)-4-[2-(dipropylamino)ethyl]-3-propylidene-1H-indol-2-one;hydrochloride |
| InChI | InChI=1S/C19H28N2O.ClH/c1-4-8-16-18-15(9-7-10-17(18)20-19(16)22)11-14-21(12-5-2)13-6-3;/h7-10H,4-6,11-14H2,1-3H3,(H,20,22);1H/b16-8-; |
| InChI Key | ZCHCNVIUIRHBLU-SQIOZQJDSA-N |
| MDL Number | MFCD24386502 |
| Molecular Formula | C19H29ClN2O |
| Molecular Weight | 336.8994 |
| SMILES | Clc1ccc(cc1)N2C(=O)N(Cc3ccccc3)C(C)C2=O |
| Synonyms | 221264-43-3,
Propylidine Ropinirole Hydrochloride(E/Z-Mixture),
(E/Z-Mixture)",
DTXSID00858346,
ACM221264433,
(E/Z)-4-[2-(Dipropylamino)ethyl]-3-propylideneindolin-2-one,
4-[2-(Dipropylamino)ethyl]-1,3-dihydro-3-propylidene-2H-indol-2-one Monohydrochloride,
(3Z)-4-[2-(Dipropylamino)ethyl]-3-propylidene-1,3-dihydro-2H-indol-2-one--hydrogen chloride (1/1),
Ropinirole Propylidene,
ZCHCNVIUIRHBLU-SQIOZQJDSA-N,
CS-CY-00050,
Propylidine Ropinirole Hydrochloride (E/Z-Mixture),
145570-92-9,
|
| Complexity | 385 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 336.197g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 336.904g/mol |
| Monoisotopic Mass | 336.197g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number