1,4-bis[2-methoxy-4-methyl-5-(propan-2-yl)benzene-1-sulfonyl]-1,4-diazepane
Chemical Structure Depiction of
1,4-bis[2-methoxy-4-methyl-5-(propan-2-yl)benzene-1-sulfonyl]-1,4-diazepane
1,4-bis[2-methoxy-4-methyl-5-(propan-2-yl)benzene-1-sulfonyl]-1,4-diazepane
Compound characteristics
| Compound ID: | 4905-1301 |
| Compound Name: | 1,4-bis[2-methoxy-4-methyl-5-(propan-2-yl)benzene-1-sulfonyl]-1,4-diazepane |
| Molecular Weight: | 552.75 |
| Molecular Formula: | C27 H40 N2 O6 S2 |
| Smiles: | CC(C)c1cc(c(cc1C)OC)S(N1CCCN(CC1)S(c1cc(C(C)C)c(C)cc1OC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1498 |
| logD: | 5.1498 |
| logSw: | -4.9915 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 79.06 |
| InChI Key: | QVDKLHJDXHEJLE-UHFFFAOYSA-N |