N-(2,4-dimethoxyphenyl)-2-[4-(4-methoxybenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-2-[4-(4-methoxybenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide
N-(2,4-dimethoxyphenyl)-2-[4-(4-methoxybenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide
Compound characteristics
| Compound ID: | C036-0153 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-2-[4-(4-methoxybenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C22 H29 N3 O6 S |
| Smiles: | COc1ccc(cc1)S(N1CCCN(CC1)CC(Nc1ccc(cc1OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7102 |
| logD: | 2.71 |
| logSw: | -3.2927 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.99 |
| InChI Key: | BZBRXUIARJBUIN-UHFFFAOYSA-N |