N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-sulfonamide
Chemical Structure Depiction of
N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-sulfonamide
N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | S796-0489 |
| Compound Name: | N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-sulfonamide |
| Molecular Weight: | 449.59 |
| Molecular Formula: | C21 H27 N3 O4 S2 |
| Smiles: | C1CCCN(C(CC(NCC1)=O)c1ccccc1)C(CNS(c1cccs1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0471 |
| logD: | 2.0427 |
| logSw: | -2.7136 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.185 |
| InChI Key: | JFUDAYOQIXKNFG-SFHVURJKSA-N |