2-(3,5-dimethylanilino)-3-(pyrrolidin-1-yl)naphthalene-1,4-dione
Chemical Structure Depiction of
2-(3,5-dimethylanilino)-3-(pyrrolidin-1-yl)naphthalene-1,4-dione
2-(3,5-dimethylanilino)-3-(pyrrolidin-1-yl)naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 6704-0033 |
| Compound Name: | 2-(3,5-dimethylanilino)-3-(pyrrolidin-1-yl)naphthalene-1,4-dione |
| Molecular Weight: | 346.43 |
| Molecular Formula: | C22 H22 N2 O2 |
| Smiles: | Cc1cc(C)cc(c1)NC1=C(C(c2ccccc2C1=O)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.5154 |
| logD: | 4.3699 |
| logSw: | -4.2937 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.3 |
| InChI Key: | HHVDBYLQPQXVIA-UHFFFAOYSA-N |