5-(methanesulfonyl)-9-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(methanesulfonyl)-9-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-1,5-diazacycloundecan-2-one
5-(methanesulfonyl)-9-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-1454 |
| Compound Name: | 5-(methanesulfonyl)-9-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 464.63 |
| Molecular Formula: | C23 H36 N4 O4 S |
| Smiles: | Cc1ccc(CN2CCN(CC2)C(C2CCCN(CCC(NCC2)=O)S(C)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3121 |
| logD: | 0.154 |
| logSw: | -2.2229 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.257 |
| InChI Key: | YEYJWYDTIGDLNM-NRFANRHFSA-N |