9-(azepane-1-carbonyl)-5-(benzenesulfonyl)-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
9-(azepane-1-carbonyl)-5-(benzenesulfonyl)-1,5-diazacycloundecan-2-one
9-(azepane-1-carbonyl)-5-(benzenesulfonyl)-1,5-diazacycloundecan-2-one
Compound characteristics
Compound ID: | S733-1536 |
Compound Name: | 9-(azepane-1-carbonyl)-5-(benzenesulfonyl)-1,5-diazacycloundecan-2-one |
Molecular Weight: | 435.59 |
Molecular Formula: | C22 H33 N3 O4 S |
Smiles: | C1CCCN(CC1)C(C1CCCN(CCC(NCC1)=O)S(c1ccccc1)(=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.5682 |
logD: | 1.5682 |
logSw: | -2.4188 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.283 |
InChI Key: | GZKWNQMXEFHFJP-IBGZPJMESA-N |