[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](phenyl)methanone
Chemical Structure Depiction of
[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](phenyl)methanone
[3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](phenyl)methanone
Compound characteristics
| Compound ID: | S340-0090 |
| Compound Name: | [3-(3-bromophenyl)-1-oxa-2,4,8-triazaspiro[4.5]dec-2-en-8-yl](phenyl)methanone |
| Molecular Weight: | 400.27 |
| Molecular Formula: | C19 H18 Br N3 O2 |
| Smiles: | C1CN(CCC12NC(c1cccc(c1)[Br])=NO2)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0509 |
| logD: | 2.9754 |
| logSw: | -3.3709 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.34 |
| InChI Key: | RQMUHRTVVKSZAV-UHFFFAOYSA-N |