4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one
4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C066-0789 |
| Compound Name: | 4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 528.61 |
| Molecular Formula: | C31 H32 N2 O6 |
| Smiles: | COc1ccc(cc1)C1C(C(N2CCC3(CC2)OCCO3)=O)c2ccccc2C(N1c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7591 |
| logD: | 3.7591 |
| logSw: | -3.9763 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.212 |
| InChI Key: | IPONSKCYNFLAGS-UHFFFAOYSA-N |