9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5-(thiophene-2-sulfonyl)-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5-(thiophene-2-sulfonyl)-1,5-diazacycloundecan-2-one
9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5-(thiophene-2-sulfonyl)-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-0248 |
| Compound Name: | 9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5-(thiophene-2-sulfonyl)-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 505.66 |
| Molecular Formula: | C23 H31 N5 O4 S2 |
| Smiles: | C1CC(CCNC(CCN(C1)S(c1cccs1)(=O)=O)=O)C(N1CCN(CC1)c1ccccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1666 |
| logD: | 1.1578 |
| logSw: | -2.3069 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.742 |
| InChI Key: | NCQMDPDEEDVXBN-IBGZPJMESA-N |