3-(4-chlorophenyl)-8-(4-fluorobenzoyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-8-(4-fluorobenzoyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
3-(4-chlorophenyl)-8-(4-fluorobenzoyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | E697-0212 |
| Compound Name: | 3-(4-chlorophenyl)-8-(4-fluorobenzoyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 385.82 |
| Molecular Formula: | C20 H17 Cl F N3 O2 |
| Smiles: | C1CN(CCC12NC(C(c1ccc(cc1)[Cl])=N2)=O)C(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5328 |
| logD: | 2.528 |
| logSw: | -3.539 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.238 |
| InChI Key: | LQCQMYPUAABGCS-UHFFFAOYSA-N |