8-(cyclopropanecarbonyl)-1-(phenoxyacetyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
Chemical Structure Depiction of
8-(cyclopropanecarbonyl)-1-(phenoxyacetyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
8-(cyclopropanecarbonyl)-1-(phenoxyacetyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
Compound characteristics
| Compound ID: | S791-0372 |
| Compound Name: | 8-(cyclopropanecarbonyl)-1-(phenoxyacetyl)-7-phenyl-1,4,8-triazacycloundecan-5-one |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C26 H31 N3 O4 |
| Smiles: | C1CN(CCNC(CC(c2ccccc2)N(C1)C(C1CC1)=O)=O)C(COc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8029 |
| logD: | 1.8029 |
| logSw: | -2.0864 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.615 |
| InChI Key: | HOYMALAWUJYQFN-QHCPKHFHSA-N |