1-[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl]-2-(2-methoxyphenyl)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-methoxyphenyl)ethan-1-one
1-[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl]-2-(2-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S340-0003 |
| Compound Name: | 1-[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl]-2-(2-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 444.33 |
| Molecular Formula: | C21 H22 Br N3 O3 |
| Smiles: | COc1ccccc1CC(N1CCC2(CC1)NC(c1cccc(c1)[Br])=NO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5514 |
| logD: | 3.4759 |
| logSw: | -3.7214 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.443 |
| InChI Key: | CSUHDHQKSVDZSQ-UHFFFAOYSA-N |