8-(benzenesulfonyl)-1,4,8-triazacycloundecan-5-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
8-(benzenesulfonyl)-1,4,8-triazacycloundecan-5-one--hydrogen chloride (1/1)
8-(benzenesulfonyl)-1,4,8-triazacycloundecan-5-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | S764-1053 |
| Compound Name: | 8-(benzenesulfonyl)-1,4,8-triazacycloundecan-5-one--hydrogen chloride (1/1) |
| Molecular Weight: | 347.86 |
| Molecular Formula: | C14 H21 N3 O3 S |
| Salt: | HCl |
| Smiles: | C1CNCCNC(CCN(C1)S(c1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.6429 |
| logD: | -2.1803 |
| logSw: | -1.9892 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.265 |
| InChI Key: | RVRZTZBQGSUBQR-UHFFFAOYSA-N |