1-(methanesulfonyl)-N-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
1-(methanesulfonyl)-N-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
1-(methanesulfonyl)-N-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-1439 |
| Compound Name: | 1-(methanesulfonyl)-N-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C21 H31 N5 O4 S |
| Smiles: | Cn1c2ccccc2nc1CCNC(C1CCCN(CCC(NCC1)=O)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.3925 |
| logD: | -0.4619 |
| logSw: | -2.0283 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.309 |
| InChI Key: | UWIZHNFIGJVEPJ-INIZCTEOSA-N |