4-bromo-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzamide
Chemical Structure Depiction of
4-bromo-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzamide
4-bromo-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzamide
Compound characteristics
| Compound ID: | Y501-4342 |
| Compound Name: | 4-bromo-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzamide |
| Molecular Weight: | 375.28 |
| Molecular Formula: | C17 H15 Br N2 O S |
| Smiles: | C1CCc2c(C#N)c(NC(c3ccc(cc3)[Br])=O)sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.007 |
| logD: | 1.4627 |
| logSw: | -4.8508 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.432 |
| InChI Key: | WFGFDUGXTHRNGB-UHFFFAOYSA-N |