1-(benzenesulfonyl)-N-[2-(1H-indol-3-yl)ethyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
1-(benzenesulfonyl)-N-[2-(1H-indol-3-yl)ethyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
1-(benzenesulfonyl)-N-[2-(1H-indol-3-yl)ethyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-1572 |
| Compound Name: | 1-(benzenesulfonyl)-N-[2-(1H-indol-3-yl)ethyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 496.63 |
| Molecular Formula: | C26 H32 N4 O4 S |
| Smiles: | C1CC(CCNC(CCN(C1)S(c1ccccc1)(=O)=O)=O)C(NCCc1c[nH]c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.684 |
| logD: | 1.684 |
| logSw: | -2.4749 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.43 |
| InChI Key: | APYTYZJYQCCJEP-FQEVSTJZSA-N |