4-benzoyl-N-[(1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)carbamothioyl]benzamide
Chemical Structure Depiction of
4-benzoyl-N-[(1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)carbamothioyl]benzamide
4-benzoyl-N-[(1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)carbamothioyl]benzamide
Compound characteristics
| Compound ID: | 3339-1850 |
| Compound Name: | 4-benzoyl-N-[(1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)carbamothioyl]benzamide |
| Molecular Weight: | 479.56 |
| Molecular Formula: | C28 H21 N3 O3 S |
| Smiles: | CCN1C(c2cccc3c(ccc1c23)NC(NC(c1ccc(cc1)C(c1ccccc1)=O)=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0988 |
| logD: | 5.0982 |
| logSw: | -5.1707 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.202 |
| InChI Key: | BJCSFRYPVLCANT-UHFFFAOYSA-N |