| CAS Number | 1156039-78-9 |
| Catalog Number | AG019J65 |
| Chemical Name | 4-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride |
| IUPAC Name | 4-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-amine;hydrochloride |
| InChI | InChI=1S/C15H14FN3S.ClH/c1-9-7-13(14-8-20-15(17)18-14)10(2)19(9)12-5-3-11(16)4-6-12;/h3-8H,1-2H3,(H2,17,18);1H |
| InChI Key | GPUJLVHRGPGPHX-UHFFFAOYSA-N |
| MDL Number | MFCD08236877 |
| Molecular Formula | C15H15ClFN3S |
| Molecular Weight | 323.8161 |
| SMILES | Cl.CC1N(C2=CC=C(F)C=C2)C(C)=C(C2N=C(N)SC=2)C=1 |
| Synonyms | 4-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride,
1156039-78-9,
AC1Q39ES,
CTK7C0667,
NE36678,
EN300-08650,
|
| Complexity | 335 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 323.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 323.814g/mol |
| Monoisotopic Mass | 323.066g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 72.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number