4-(4-methylbenzoyl)-8-(3-nitrobenzoyl)-N-[(pyridin-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
4-(4-methylbenzoyl)-8-(3-nitrobenzoyl)-N-[(pyridin-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
4-(4-methylbenzoyl)-8-(3-nitrobenzoyl)-N-[(pyridin-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
| Compound ID: | V011-9863 |
| Compound Name: | 4-(4-methylbenzoyl)-8-(3-nitrobenzoyl)-N-[(pyridin-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide |
| Molecular Weight: | 543.58 |
| Molecular Formula: | C29 H29 N5 O6 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(N1C(COC12CCN(CC2)C(c1cccc(c1)[N+]([O-])=O)=O)C(NCc1ccccn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1102 |
| logD: | 2.1097 |
| logSw: | -2.7929 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.92 |
| InChI Key: | DQKVOWQACUPBQV-RUZDIDTESA-N |