2-{[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-4-methylphenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-4-methylphenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione
2-{[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-4-methylphenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | F383-0147 |
| Compound Name: | 2-{[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-4-methylphenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 462.56 |
| Molecular Formula: | C23 H30 N2 O6 S |
| Smiles: | Cc1ccc(CN2C(C3CCCCC3C2=O)=O)cc1S(N1CCC2(CC1)OCCO2)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3828 |
| logD: | 2.3828 |
| logSw: | -3.0178 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.831 |
| InChI Key: | XJEFVTVDGNNRPI-UHFFFAOYSA-N |