1-(2H-1,3-benzodioxole-5-carbonyl)-7'-chloro-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Chemical Structure Depiction of
1-(2H-1,3-benzodioxole-5-carbonyl)-7'-chloro-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
1-(2H-1,3-benzodioxole-5-carbonyl)-7'-chloro-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Compound characteristics
| Compound ID: | P500-1489 |
| Compound Name: | 1-(2H-1,3-benzodioxole-5-carbonyl)-7'-chloro-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one |
| Molecular Weight: | 399.83 |
| Molecular Formula: | C20 H18 Cl N3 O4 |
| Smiles: | C1CN(CCC12NC(c1ccc(cc1N2)[Cl])=O)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1566 |
| logD: | 2.1566 |
| logSw: | -3.5053 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.314 |
| InChI Key: | RBJZEVVROONULJ-UHFFFAOYSA-N |