6'-chloro-1'-methyl-1-(3-methylbenzoyl)-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Chemical Structure Depiction of
6'-chloro-1'-methyl-1-(3-methylbenzoyl)-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
6'-chloro-1'-methyl-1-(3-methylbenzoyl)-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Compound characteristics
| Compound ID: | P500-0424 |
| Compound Name: | 6'-chloro-1'-methyl-1-(3-methylbenzoyl)-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one |
| Molecular Weight: | 383.88 |
| Molecular Formula: | C21 H22 Cl N3 O2 |
| Smiles: | Cc1cccc(c1)C(N1CCC2(CC1)NC(c1cc(ccc1N2C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7969 |
| logD: | 2.7969 |
| logSw: | -3.7125 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.639 |
| InChI Key: | YQGBNURZTUMCBG-UHFFFAOYSA-N |