1-[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl]-2-(2-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl]-2-(2-methylphenyl)ethan-1-one
1-[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl]-2-(2-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S340-0057 |
| Compound Name: | 1-[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl]-2-(2-methylphenyl)ethan-1-one |
| Molecular Weight: | 428.33 |
| Molecular Formula: | C21 H22 Br N3 O2 |
| Smiles: | Cc1ccccc1CC(N1CCC2(CC1)NC(c1cccc(c1)[Br])=NO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1921 |
| logD: | 4.1166 |
| logSw: | -4.2985 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.813 |
| InChI Key: | GXGBJTZFCAZBNZ-UHFFFAOYSA-N |