2-(4-methoxyphenyl)-4-[(3-methylanilino)methylidene]isoquinoline-1,3(2H,4H)-dione
Chemical Structure Depiction of
2-(4-methoxyphenyl)-4-[(3-methylanilino)methylidene]isoquinoline-1,3(2H,4H)-dione
2-(4-methoxyphenyl)-4-[(3-methylanilino)methylidene]isoquinoline-1,3(2H,4H)-dione
Compound characteristics
| Compound ID: | 5122-2914 |
| Compound Name: | 2-(4-methoxyphenyl)-4-[(3-methylanilino)methylidene]isoquinoline-1,3(2H,4H)-dione |
| Molecular Weight: | 384.43 |
| Molecular Formula: | C24 H20 N2 O3 |
| Smiles: | Cc1cccc(c1)N/C=C1C(N(C(c2ccccc\12)=O)c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7837 |
| logD: | 3.7836 |
| logSw: | -4.028 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.387 |
| InChI Key: | CHCWKZSQDOOJPU-UHFFFAOYSA-N |