methyl 5-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 5-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
methyl 5-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F602-1080 |
| Compound Name: | methyl 5-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 433.5 |
| Molecular Formula: | C22 H31 N3 O6 |
| Smiles: | Cc1c(C(=O)OC)c(C)[nH]c1C(N1CCCC(C1)C(N1CCC2(CC1)OCCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8597 |
| logD: | 0.8597 |
| logSw: | -1.1852 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.061 |
| InChI Key: | KMPWJCRZRPYAOS-INIZCTEOSA-N |