8-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane
Chemical Structure Depiction of
8-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane
8-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane
Compound characteristics
| Compound ID: | K405-0700 |
| Compound Name: | 8-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane |
| Molecular Weight: | 460.96 |
| Molecular Formula: | C26 H25 Cl N4 O2 |
| Smiles: | Cc1ccc(cc1[Cl])n1cc(c2ccccc2)c2c(ncnc12)N1CCC2(CC1)OCCO2 |
| Stereo: | ACHIRAL |
| logP: | 5.9376 |
| logD: | 5.8297 |
| logSw: | -6.0656 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.649 |
| InChI Key: | DUCPGCVGWLEIJJ-UHFFFAOYSA-N |