[rel-(1R,5S)-7-(2-methoxyethyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonan-3-yl][5-(4-methoxyphenyl)-1,2-dimethyl-1H-pyrrol-3-yl]methanone
Chemical Structure Depiction of
[rel-(1R,5S)-7-(2-methoxyethyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonan-3-yl][5-(4-methoxyphenyl)-1,2-dimethyl-1H-pyrrol-3-yl]methanone
[rel-(1R,5S)-7-(2-methoxyethyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonan-3-yl][5-(4-methoxyphenyl)-1,2-dimethyl-1H-pyrrol-3-yl]methanone
Compound characteristics
| Compound ID: | S301-0956 |
| Compound Name: | [rel-(1R,5S)-7-(2-methoxyethyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonan-3-yl][5-(4-methoxyphenyl)-1,2-dimethyl-1H-pyrrol-3-yl]methanone |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C23 H31 N3 O4 |
| Smiles: | Cc1c(cc(c2ccc(cc2)OC)n1C)C(N1C[C@@H]2CN(CCOC)C[C@H](C1)O2)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8884 |
| logD: | 1.7826 |
| logSw: | -2.4832 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.527 |
| InChI Key: | IDHKXEHQUXARLX-PMACEKPBSA-N |