1-[4-amino-2-(2,3-dimethylanilino)-1,3-thiazol-5-yl]-3-methylbutan-1-one
Chemical Structure Depiction of
1-[4-amino-2-(2,3-dimethylanilino)-1,3-thiazol-5-yl]-3-methylbutan-1-one
1-[4-amino-2-(2,3-dimethylanilino)-1,3-thiazol-5-yl]-3-methylbutan-1-one
Compound characteristics
| Compound ID: | F091-0642 |
| Compound Name: | 1-[4-amino-2-(2,3-dimethylanilino)-1,3-thiazol-5-yl]-3-methylbutan-1-one |
| Molecular Weight: | 303.42 |
| Molecular Formula: | C16 H21 N3 O S |
| Smiles: | CC(C)CC(c1c(N)nc(Nc2cccc(C)c2C)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8321 |
| logD: | 4.8312 |
| logSw: | -4.5759 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 52.443 |
| InChI Key: | KYBGXZHCZXRCKA-UHFFFAOYSA-N |