3-[4-(dimethylamino)but-3-en-2-ylidene]-1,5-dimethyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione
Chemical Structure Depiction of
3-[4-(dimethylamino)but-3-en-2-ylidene]-1,5-dimethyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione
3-[4-(dimethylamino)but-3-en-2-ylidene]-1,5-dimethyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | 8005-2304 |
| Compound Name: | 3-[4-(dimethylamino)but-3-en-2-ylidene]-1,5-dimethyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione |
| Molecular Weight: | 299.37 |
| Molecular Formula: | C17 H21 N3 O2 |
| Smiles: | CC(/C=C/N(C)C)=C1C(N(C)c2ccccc2N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8256 |
| logD: | 0.8122 |
| logSw: | -1.3536 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.427 |
| InChI Key: | KYGYXVQGIAWPGC-UHFFFAOYSA-N |