8-(benzenesulfonyl)-1-(1-methyl-1H-indazole-3-carbonyl)-1,4,8-triazacycloundecan-5-one
Chemical Structure Depiction of
8-(benzenesulfonyl)-1-(1-methyl-1H-indazole-3-carbonyl)-1,4,8-triazacycloundecan-5-one
8-(benzenesulfonyl)-1-(1-methyl-1H-indazole-3-carbonyl)-1,4,8-triazacycloundecan-5-one
Compound characteristics
| Compound ID: | S764-1028 |
| Compound Name: | 8-(benzenesulfonyl)-1-(1-methyl-1H-indazole-3-carbonyl)-1,4,8-triazacycloundecan-5-one |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C23 H27 N5 O4 S |
| Smiles: | Cn1c2ccccc2c(C(N2CCCN(CCC(NCC2)=O)S(c2ccccc2)(=O)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.9008 |
| logD: | 0.9008 |
| logSw: | -2.3722 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.296 |
| InChI Key: | XVDNEKZYIJTKBZ-UHFFFAOYSA-N |