| CAS Number | 197431-02-0 |
| Catalog Number | AG00ADVS(AGN-PC-0QP1FU) |
| Chemical Name | SR 35021 |
| IUPAC Name | N-[2-butyl-3-[4-[3-(butylamino)propoxy]benzoyl]-1-benzofuran-5-yl]methanesulfonamide;hydrochloride |
| InChI | InChI=1S/C27H36N2O5S.ClH/c1-4-6-9-25-26(23-19-21(29-35(3,31)32)12-15-24(23)34-25)27(30)20-10-13-22(14-11-20)33-18-8-17-28-16-7-5-2;/h10-15,19,28-29H,4-9,16-18H2,1-3H3;1H |
| InChI Key | ZDXBTJLIQYUYSZ-UHFFFAOYSA-N |
| MDL Number | MFCD21363566 |
| Molecular Formula | C27H37ClN2O5S |
| Molecular Weight | 537.1111 |
| SMILES | Cl.C(CCC)C=1OC2=C(C1C(C1=CC=C(C=C1)OCCCNCCCC)=O)C=C(C=C2)NS(=O)(=O)C |
| Synonyms | 197431-02-0,
Desbutyl Dronedarone Hydrochloride,
Dronedarone Impurity D,
DTXSID50747514,
FT-0665949,
2-n-butyl-3-[4-(3-n-butylamino-propoxy)-ben-zoyl]-5-methylsulphonamido-benzofuran hydrochloride,
N-(2-Butyl-3-{4-[3-(butylamino)propoxy]benzoyl}-1-benzofuran-5-yl)methanesulfonamide--hydrogen chloride (1/1),
N-[2-Butyl-3-[4-[3-(butylamino)propoxy]benzoyl]-5-benzofuranyl]-methanesulfonamide Hydrochloride,
N-desbutyl Dronedarone D7,
ZDXBTJLIQYUYSZ-UHFFFAOYSA-N,
Dronedarone HCl Related Compound A,
CS-O-05554,
SR 35021,
Dronedarone Hydrochloride Related Compound A,
|
| Complexity | 732 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 536.211g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 36 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 537.112g/mol |
| Monoisotopic Mass | 536.211g/mol |
| Rotatable Bond Count | 15 |
| 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