1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]carbamimidothioate
Chemical Structure Depiction of
1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]carbamimidothioate
1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]carbamimidothioate
Compound characteristics
| Compound ID: | 8009-7406 |
| Compound Name: | 1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]carbamimidothioate |
| Molecular Weight: | 580.15 |
| Molecular Formula: | C31 H34 Cl N3 O4 S |
| Smiles: | CCCCCCOc1ccc(cc1)N1C(CC(C1=O)SC(/NCc1ccc(cc1)OC)=N/c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6557 |
| logD: | 6.6533 |
| logSw: | -6.2079 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.729 |
| InChI Key: | LQWIVPLNKZUPEO-NDEPHWFRSA-N |