1'-(3,4,5-trimethoxybenzoyl)-5',6',7',8'-tetrahydro-1'H-spiro[cyclohexane-1,2'-quinazolin]-4'(3'H)-one
Chemical Structure Depiction of
1'-(3,4,5-trimethoxybenzoyl)-5',6',7',8'-tetrahydro-1'H-spiro[cyclohexane-1,2'-quinazolin]-4'(3'H)-one
1'-(3,4,5-trimethoxybenzoyl)-5',6',7',8'-tetrahydro-1'H-spiro[cyclohexane-1,2'-quinazolin]-4'(3'H)-one
Compound characteristics
| Compound ID: | D070-0019 |
| Compound Name: | 1'-(3,4,5-trimethoxybenzoyl)-5',6',7',8'-tetrahydro-1'H-spiro[cyclohexane-1,2'-quinazolin]-4'(3'H)-one |
| Molecular Weight: | 414.5 |
| Molecular Formula: | C23 H30 N2 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1C2CCCCC=2C(NC12CCCCC2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9691 |
| logD: | 2.9646 |
| logSw: | -3.3297 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.31 |
| InChI Key: | LPEYLJRDNNMJNU-UHFFFAOYSA-N |