N-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(4-ethylbenzoyl)-4-(3-methylbenzoyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(4-ethylbenzoyl)-4-(3-methylbenzoyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(4-ethylbenzoyl)-4-(3-methylbenzoyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
| Compound ID: | V028-0490 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(4-ethylbenzoyl)-4-(3-methylbenzoyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide |
| Molecular Weight: | 569.66 |
| Molecular Formula: | C33 H35 N3 O6 |
| Smiles: | CCc1ccc(cc1)C(N1CCC2(CC1)N(C(CO2)C(NCc1ccc2c(c1)OCO2)=O)C(c1cccc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8655 |
| logD: | 3.8655 |
| logSw: | -3.897 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.111 |
| InChI Key: | LKSFTUCBQKBJSP-HHHXNRCGSA-N |