N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-carboxamide
N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | S796-0332 |
| Compound Name: | N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-carboxamide |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C22 H27 N3 O3 S |
| Smiles: | C1CCCN(C(CC(NCC1)=O)c1ccccc1)C(CNC(c1cccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3374 |
| logD: | 2.3374 |
| logSw: | -2.8055 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.84 |
| InChI Key: | XTZFNTFSZUGGHS-SFHVURJKSA-N |