8-(benzenesulfonyl)-1-(1-methyl-1H-imidazole-4-carbonyl)-1,4,8-triazacycloundecan-5-one
Chemical Structure Depiction of
8-(benzenesulfonyl)-1-(1-methyl-1H-imidazole-4-carbonyl)-1,4,8-triazacycloundecan-5-one
8-(benzenesulfonyl)-1-(1-methyl-1H-imidazole-4-carbonyl)-1,4,8-triazacycloundecan-5-one
Compound characteristics
| Compound ID: | S764-1037 |
| Compound Name: | 8-(benzenesulfonyl)-1-(1-methyl-1H-imidazole-4-carbonyl)-1,4,8-triazacycloundecan-5-one |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C19 H25 N5 O4 S |
| Smiles: | Cn1cc(C(N2CCCN(CCC(NCC2)=O)S(c2ccccc2)(=O)=O)=O)nc1 |
| Stereo: | ACHIRAL |
| logP: | -0.3876 |
| logD: | -0.3876 |
| logSw: | -2.1191 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.396 |
| InChI Key: | UIFLDYNISFKHEP-UHFFFAOYSA-N |