ethyl 1-{4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl}piperidine-4-carboxylate
ethyl 1-{4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V023-0951 |
| Compound Name: | ethyl 1-{4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonyl}piperidine-4-carboxylate |
| Molecular Weight: | 510.52 |
| Molecular Formula: | C26 H27 F N4 O6 |
| Smiles: | CCOC(C1CCN(CC1)C(C1C(N(Cc2ccc(cc2)F)C(N(c2ccc(cc2)OC)N=1)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1611 |
| logD: | 3.1611 |
| logSw: | -3.0929 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.191 |
| InChI Key: | BOADPZMZBDROOE-UHFFFAOYSA-N |