1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-N-(3-phenylpropyl)-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-N-(3-phenylpropyl)-1,5-diazacycloundecane-8-carboxamide
1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-N-(3-phenylpropyl)-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-1736 |
| Compound Name: | 1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-N-(3-phenylpropyl)-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 475.61 |
| Molecular Formula: | C23 H33 N5 O4 S |
| Smiles: | Cn1cc(nc1)S(N1CCCC(CCNC(CC1)=O)C(NCCCc1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.61 |
| logD: | 0.61 |
| logSw: | -2.2685 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.97 |
| InChI Key: | QAENQHNRXVBIPB-FQEVSTJZSA-N |