N-(3-methoxyphenyl)-2-{[(2-methoxyphenyl)methyl]amino}-5-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl}benzene-1-sulfonamide
Chemical Structure Depiction of
N-(3-methoxyphenyl)-2-{[(2-methoxyphenyl)methyl]amino}-5-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl}benzene-1-sulfonamide
N-(3-methoxyphenyl)-2-{[(2-methoxyphenyl)methyl]amino}-5-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | K659-0748 |
| Compound Name: | N-(3-methoxyphenyl)-2-{[(2-methoxyphenyl)methyl]amino}-5-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl}benzene-1-sulfonamide |
| Molecular Weight: | 690.82 |
| Molecular Formula: | C36 H42 N4 O8 S |
| Smiles: | COc1cccc(c1)NS(c1cc(ccc1NCc1ccccc1OC)C(N1CCN(CC1)Cc1ccc(c(c1OC)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4024 |
| logD: | 3.9168 |
| logSw: | -4.2499 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.852 |
| InChI Key: | VPBBDWRTLKVCTO-UHFFFAOYSA-N |