8-(2-chlorobenzoyl)-3-(4-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-(2-chlorobenzoyl)-3-(4-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
8-(2-chlorobenzoyl)-3-(4-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | E697-0358 |
| Compound Name: | 8-(2-chlorobenzoyl)-3-(4-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 397.86 |
| Molecular Formula: | C21 H20 Cl N3 O3 |
| Smiles: | COc1ccc(cc1)C1C(NC2(CCN(CC2)C(c2ccccc2[Cl])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3053 |
| logD: | 2.3005 |
| logSw: | -3.5562 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.781 |
| InChI Key: | WKTCJMYSBUPKSU-UHFFFAOYSA-N |