{4-[2-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl]phenyl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
Chemical Structure Depiction of
{4-[2-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl]phenyl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
{4-[2-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl]phenyl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
Compound characteristics
| Compound ID: | L123-1074 |
| Compound Name: | {4-[2-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl]phenyl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone |
| Molecular Weight: | 516.64 |
| Molecular Formula: | C31 H36 N2 O5 |
| Smiles: | COc1ccc(c(c1)c1cc2CCCCCc2n1c1ccc(cc1)C(N1CCC2(CC1)OCCO2)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.7575 |
| logD: | 4.7575 |
| logSw: | -4.495 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.157 |
| InChI Key: | ZDUYKWIPLMLMEX-UHFFFAOYSA-N |