| CAS Number | 866914-87-6 |
| Catalog Number | AG01E5K9(AGN-PC-0V7Y1B) |
| Chemical Name | ARL 17477 |
| IUPAC Name | N'-[4-[2-[(3-chlorophenyl)methylamino]ethyl]phenyl]thiophene-2-carboximidamide;dihydrochloride |
| InChI | InChI=1S/C20H20ClN3S.2ClH/c21-17-4-1-3-16(13-17)14-23-11-10-15-6-8-18(9-7-15)24-20(22)19-5-2-12-25-19;;/h1-9,12-13,23H,10-11,14H2,(H2,22,24);2*1H |
| InChI Key | SOXBYIKSUDXMIE-UHFFFAOYSA-N |
| MDL Number | MFCD21608518 |
| Molecular Formula | C20H22Cl3N3S |
| Molecular Weight | 442.8328 |
| SMILES | [H]Cl.[H]Cl.N(C1C=CC(CCNCC2C=CC=C(Cl)C=2)=CC=1)C(C1SC=CC=1)=N |
| Synonyms | ARL 17477 dihydrochloride,
866914-87-6,
ARL17477Dihydrochloride,
ARL-17477 dihydrochloride,
ARL-17477 dihydrochloride hydrate,
MFCD21608518,
AKOS024457549,
180983-17-9,
LS-193262,
J-011553,
N-[4-[2-[[(3-Chlorophenyl)methyl]amino]ethyl]phenyl]-2-thiophenecarboxamide dihydrochloride,
N-[4-[2-[[(3-chlorophenyl)methyl]amino]ethyl]phenyl]-2-thiophenecarboximidamide dihydrochloride hydrate,
SOXBYIKSUDXMIE-UHFFFAOYSA-N,
CID9824646,
N'-[4-[2-[(3-chlorophenyl)methylamino]ethyl]phenyl]thiophene-2-carboximidamide Dihydrochloride,
|
| Complexity | 423 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 441.06g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 442.827g/mol |
| Monoisotopic Mass | 441.06g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 78.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number