9-(hydroxymethyl)-5-(thiophene-2-sulfonyl)-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
9-(hydroxymethyl)-5-(thiophene-2-sulfonyl)-1,5-diazacycloundecan-2-one
9-(hydroxymethyl)-5-(thiophene-2-sulfonyl)-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S786-0246 |
| Compound Name: | 9-(hydroxymethyl)-5-(thiophene-2-sulfonyl)-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 346.47 |
| Molecular Formula: | C14 H22 N2 O4 S2 |
| Smiles: | C1CC(CCNC(CCN(C1)S(c1cccs1)(=O)=O)=O)CO |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4982 |
| logD: | 0.4982 |
| logSw: | -2.1351 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.438 |
| InChI Key: | NXDXNZMRBIRDRG-LBPRGKRZSA-N |