2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1,3-dioxo-N-(2,4,6-trimethylphenyl)-2,3-dihydro-1H-isoindole-5-carboxamide
Chemical Structure Depiction of
2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1,3-dioxo-N-(2,4,6-trimethylphenyl)-2,3-dihydro-1H-isoindole-5-carboxamide
2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1,3-dioxo-N-(2,4,6-trimethylphenyl)-2,3-dihydro-1H-isoindole-5-carboxamide
Compound characteristics
| Compound ID: | 2922-2942 |
| Compound Name: | 2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1,3-dioxo-N-(2,4,6-trimethylphenyl)-2,3-dihydro-1H-isoindole-5-carboxamide |
| Molecular Weight: | 537.59 |
| Molecular Formula: | C30 H23 N3 O5 S |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(c1ccc2C(N(C(c2c1)=O)c1ccc(cc1)Sc1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3681 |
| logD: | 6.3651 |
| logSw: | -5.5295 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.685 |
| InChI Key: | OIRUUELYHWJFCN-UHFFFAOYSA-N |