{4-amino-2-[3-(methylsulfanyl)anilino]-1,3-thiazol-5-yl}(3-bromophenyl)methanone
Chemical Structure Depiction of
{4-amino-2-[3-(methylsulfanyl)anilino]-1,3-thiazol-5-yl}(3-bromophenyl)methanone
{4-amino-2-[3-(methylsulfanyl)anilino]-1,3-thiazol-5-yl}(3-bromophenyl)methanone
Compound characteristics
| Compound ID: | F091-1106 |
| Compound Name: | {4-amino-2-[3-(methylsulfanyl)anilino]-1,3-thiazol-5-yl}(3-bromophenyl)methanone |
| Molecular Weight: | 420.35 |
| Molecular Formula: | C17 H14 Br N3 O S2 |
| Smiles: | CSc1cccc(c1)Nc1nc(c(C(c2cccc(c2)[Br])=O)s1)N |
| Stereo: | ACHIRAL |
| logP: | 5.543 |
| logD: | 5.543 |
| logSw: | -5.4941 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 53.361 |
| InChI Key: | SRMUXPRYEZBVLR-UHFFFAOYSA-N |