4-(4-chlorobenzoyl)-2,6-bis(4-hydroxyphenyl)pyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetrone
Chemical Structure Depiction of
4-(4-chlorobenzoyl)-2,6-bis(4-hydroxyphenyl)pyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetrone
4-(4-chlorobenzoyl)-2,6-bis(4-hydroxyphenyl)pyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetrone
Compound characteristics
| Compound ID: | 5042-0440 |
| Compound Name: | 4-(4-chlorobenzoyl)-2,6-bis(4-hydroxyphenyl)pyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetrone |
| Molecular Weight: | 538.9 |
| Molecular Formula: | C29 H15 Cl N2 O7 |
| Smiles: | c1cc(ccc1C(c1c2C(N(C(c2cc2C(N(C(c12)=O)c1ccc(cc1)O)=O)=O)c1ccc(cc1)O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.7924 |
| logD: | 2.791 |
| logSw: | -3.4886 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.222 |
| InChI Key: | RKRSXZHOQZUTFM-UHFFFAOYSA-N |