(1,4-dioxa-8-azaspiro[4.5]decan-8-yl){1-[(4-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrol-2-yl}methanone
Chemical Structure Depiction of
(1,4-dioxa-8-azaspiro[4.5]decan-8-yl){1-[(4-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrol-2-yl}methanone
(1,4-dioxa-8-azaspiro[4.5]decan-8-yl){1-[(4-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrol-2-yl}methanone
Compound characteristics
| Compound ID: | P076-0721 |
| Compound Name: | (1,4-dioxa-8-azaspiro[4.5]decan-8-yl){1-[(4-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrol-2-yl}methanone |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C25 H27 N3 O3 |
| Smiles: | Cc1ccc(Cn2cc(cc2C(N2CCC3(CC2)OCCO3)=O)c2ccncc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1735 |
| logD: | 3.1686 |
| logSw: | -2.8848 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.963 |
| InChI Key: | ASXPEMSLEJVEIG-UHFFFAOYSA-N |