[3-(4-chlorophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](4-ethoxyphenyl)methanone
Chemical Structure Depiction of
[3-(4-chlorophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](4-ethoxyphenyl)methanone
[3-(4-chlorophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](4-ethoxyphenyl)methanone
Compound characteristics
Compound ID: | S340-0582 |
Compound Name: | [3-(4-chlorophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](4-ethoxyphenyl)methanone |
Molecular Weight: | 399.88 |
Molecular Formula: | C21 H22 Cl N3 O3 |
Smiles: | CCOc1ccc(cc1)C(N1CCC2(CC1)NC(c1ccc(cc1)[Cl])=NO2)=O |
Stereo: | ACHIRAL |
logP: | 3.3483 |
logD: | 3.2659 |
logSw: | -3.7563 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.464 |
InChI Key: | JNSHEHQKKWTIEO-UHFFFAOYSA-N |