N-{1-[5-(4-bromophenyl)furan-2-yl]-3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{1-[5-(4-bromophenyl)furan-2-yl]-3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
N-{1-[5-(4-bromophenyl)furan-2-yl]-3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Compound characteristics
| Compound ID: | 1501-0764 |
| Compound Name: | N-{1-[5-(4-bromophenyl)furan-2-yl]-3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]-3-oxoprop-1-en-2-yl}-4-methylbenzamide |
| Molecular Weight: | 543.44 |
| Molecular Formula: | C25 H23 Br N2 O5 S |
| Smiles: | Cc1ccc(cc1)C(NC(=C/c1ccc(c2ccc(cc2)[Br])o1)\C(NC1CCS(C1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1324 |
| logD: | 3.7917 |
| logSw: | -4.1832 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.309 |
| InChI Key: | ULUFROOLTZJVNB-FQEVSTJZSA-N |