5-(benzenesulfonyl)-9-[4-(prop-2-en-1-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(benzenesulfonyl)-9-[4-(prop-2-en-1-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
5-(benzenesulfonyl)-9-[4-(prop-2-en-1-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-1609 |
| Compound Name: | 5-(benzenesulfonyl)-9-[4-(prop-2-en-1-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 462.61 |
| Molecular Formula: | C23 H34 N4 O4 S |
| Smiles: | C=CCN1CCN(CC1)C(C1CCCN(CCC(NCC1)=O)S(c1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4917 |
| logD: | 0.3627 |
| logSw: | -2.259 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.743 |
| InChI Key: | PBXJTONRVJGUCO-FQEVSTJZSA-N |