1-[4-amino-2-(3-bromoanilino)-1,3-thiazol-5-yl]-3-methylbutan-1-one
Chemical Structure Depiction of
1-[4-amino-2-(3-bromoanilino)-1,3-thiazol-5-yl]-3-methylbutan-1-one
1-[4-amino-2-(3-bromoanilino)-1,3-thiazol-5-yl]-3-methylbutan-1-one
Compound characteristics
| Compound ID: | F091-0894 |
| Compound Name: | 1-[4-amino-2-(3-bromoanilino)-1,3-thiazol-5-yl]-3-methylbutan-1-one |
| Molecular Weight: | 354.27 |
| Molecular Formula: | C14 H16 Br N3 O S |
| Smiles: | CC(C)CC(c1c(N)nc(Nc2cccc(c2)[Br])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7502 |
| logD: | 4.7501 |
| logSw: | -4.6293 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 53.141 |
| InChI Key: | KYXAJVWEFWYVFQ-UHFFFAOYSA-N |