8-[(2-chloro-4-fluorophenyl)methyl]-3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-[(2-chloro-4-fluorophenyl)methyl]-3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
8-[(2-chloro-4-fluorophenyl)methyl]-3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
Compound ID: | G610-0420 |
Compound Name: | 8-[(2-chloro-4-fluorophenyl)methyl]-3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
Molecular Weight: | 406.29 |
Molecular Formula: | C20 H18 Cl2 F N3 O |
Smiles: | C1CN(CCC12NC(C(c1ccc(cc1)[Cl])=N2)=O)Cc1ccc(cc1[Cl])F |
Stereo: | ACHIRAL |
logP: | 4.171 |
logD: | 3.4935 |
logSw: | -4.5118 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 37.322 |
InChI Key: | UXWFUWIZFZOADQ-UHFFFAOYSA-N |