N-[(2-methoxyphenyl)methyl]-1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-[(2-methoxyphenyl)methyl]-1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-[(2-methoxyphenyl)methyl]-1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-1712 |
| Compound Name: | N-[(2-methoxyphenyl)methyl]-1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C22 H31 N5 O5 S |
| Smiles: | Cn1cc(nc1)S(N1CCCC(CCNC(CC1)=O)C(NCc1ccccc1OC)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.3187 |
| logD: | -0.3187 |
| logSw: | -2.11 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.759 |
| InChI Key: | BJDIGQDCTOAOQO-KRWDZBQOSA-N |