4-[(4-butylanilino)methylidene]-2-(2-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione
Chemical Structure Depiction of
4-[(4-butylanilino)methylidene]-2-(2-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione
4-[(4-butylanilino)methylidene]-2-(2-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione
Compound characteristics
| Compound ID: | 5122-2978 |
| Compound Name: | 4-[(4-butylanilino)methylidene]-2-(2-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C27 H26 N2 O3 |
| Smiles: | CCCCc1ccc(cc1)N/C=C1C(N(C(c2ccccc\12)=O)c1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.442 |
| logD: | 5.442 |
| logSw: | -5.3971 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.173 |
| InChI Key: | SRZMCIZAKQWCGJ-UHFFFAOYSA-N |