[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](3,5-dimethylphenyl)methanone
Chemical Structure Depiction of
[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](3,5-dimethylphenyl)methanone
[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](3,5-dimethylphenyl)methanone
Compound characteristics
| Compound ID: | S340-0094 |
| Compound Name: | [3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](3,5-dimethylphenyl)methanone |
| Molecular Weight: | 428.33 |
| Molecular Formula: | C21 H22 Br N3 O2 |
| Smiles: | Cc1cc(C)cc(c1)C(N1CCC2(CC1)NC(c1cccc(c1)[Br])=NO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9404 |
| logD: | 3.8649 |
| logSw: | -3.9026 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.34 |
| InChI Key: | PESUHPRMPPGUKM-UHFFFAOYSA-N |