8-(benzenesulfonyl)-N,N-diethyl-5-oxo-1,4,8-triazacycloundecane-1-carboxamide
Chemical Structure Depiction of
8-(benzenesulfonyl)-N,N-diethyl-5-oxo-1,4,8-triazacycloundecane-1-carboxamide
8-(benzenesulfonyl)-N,N-diethyl-5-oxo-1,4,8-triazacycloundecane-1-carboxamide
Compound characteristics
| Compound ID: | S764-1188 |
| Compound Name: | 8-(benzenesulfonyl)-N,N-diethyl-5-oxo-1,4,8-triazacycloundecane-1-carboxamide |
| Molecular Weight: | 410.53 |
| Molecular Formula: | C19 H30 N4 O4 S |
| Smiles: | CCN(CC)C(N1CCCN(CCC(NCC1)=O)S(c1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1945 |
| logD: | 1.1945 |
| logSw: | -2.3209 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.85 |
| InChI Key: | PTDAJPZGPIMGSU-UHFFFAOYSA-N |