2-(3-methoxyanilino)-3-(pyrrolidin-1-yl)naphthalene-1,4-dione
Chemical Structure Depiction of
2-(3-methoxyanilino)-3-(pyrrolidin-1-yl)naphthalene-1,4-dione
2-(3-methoxyanilino)-3-(pyrrolidin-1-yl)naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 6704-0051 |
| Compound Name: | 2-(3-methoxyanilino)-3-(pyrrolidin-1-yl)naphthalene-1,4-dione |
| Molecular Weight: | 348.4 |
| Molecular Formula: | C21 H20 N2 O3 |
| Smiles: | COc1cccc(c1)NC1=C(C(c2ccccc2C1=O)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.8889 |
| logD: | 3.6161 |
| logSw: | -4.0959 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.844 |
| InChI Key: | ILEQPDNBSMYVRQ-UHFFFAOYSA-N |