8-(benzenesulfonyl)-1-propanoyl-1,4,8-triazacycloundecan-5-one
Chemical Structure Depiction of
8-(benzenesulfonyl)-1-propanoyl-1,4,8-triazacycloundecan-5-one
8-(benzenesulfonyl)-1-propanoyl-1,4,8-triazacycloundecan-5-one
Compound characteristics
| Compound ID: | S764-1064 |
| Compound Name: | 8-(benzenesulfonyl)-1-propanoyl-1,4,8-triazacycloundecan-5-one |
| Molecular Weight: | 367.47 |
| Molecular Formula: | C17 H25 N3 O4 S |
| Smiles: | CCC(N1CCCN(CCC(NCC1)=O)S(c1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3723 |
| logD: | 0.3723 |
| logSw: | -2.2661 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.504 |
| InChI Key: | FHYYQGLANRRBDB-UHFFFAOYSA-N |