5'-methyl-1-(3-nitrobenzoyl)-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Chemical Structure Depiction of
5'-methyl-1-(3-nitrobenzoyl)-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
5'-methyl-1-(3-nitrobenzoyl)-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Compound characteristics
| Compound ID: | V025-2742 |
| Compound Name: | 5'-methyl-1-(3-nitrobenzoyl)-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C20 H20 N4 O4 |
| Smiles: | Cc1cccc2c1C(NC1(CCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O)N2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3036 |
| logD: | 2.3036 |
| logSw: | -2.8488 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.58 |
| InChI Key: | MXPDQSIYKZNGJR-UHFFFAOYSA-N |