1-(benzenesulfonyl)-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
1-(benzenesulfonyl)-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]-1,5-diazacycloundecane-8-carboxamide
1-(benzenesulfonyl)-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-1615 |
| Compound Name: | 1-(benzenesulfonyl)-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 464.63 |
| Molecular Formula: | C23 H36 N4 O4 S |
| Smiles: | C1CCN(C1)CCCNC(C1CCCN(CCC(NCC1)=O)S(c1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3373 |
| logD: | -2.7532 |
| logSw: | -2.2306 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.907 |
| InChI Key: | BRJGTYUPGGBRPO-FQEVSTJZSA-N |