| CAS Number | 1170210-77-1 |
| Catalog Number | AG019K18 |
| Chemical Name | 4-[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride |
| IUPAC Name | 4-[1-(3,4-dichlorophenyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-amine;hydrochloride |
| InChI | InChI=1S/C15H13Cl2N3S.ClH/c1-8-5-11(14-7-21-15(18)19-14)9(2)20(8)10-3-4-12(16)13(17)6-10;/h3-7H,1-2H3,(H2,18,19);1H |
| InChI Key | NLXIQBGADFLXLH-UHFFFAOYSA-N |
| MDL Number | MFCD08447197 |
| Molecular Formula | C15H14Cl3N3S |
| Molecular Weight | 374.7158 |
| SMILES | Cl.CC1N(C2=CC(Cl)=C(Cl)C=C2)C(C)=C(C2N=C(N)SC=2)C=1 |
| Synonyms | 4-[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride,
1170210-77-1,
AC1Q39EQ,
CTK7E1724,
MCULE-5610122330,
NE35317,
EN300-10929,
4-(1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)thiazol-2-amine hydrochloride,
|
| Complexity | 373 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 372.997g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 374.708g/mol |
| Monoisotopic Mass | 372.997g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 72.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number