3-(4-bromophenyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione
Chemical Structure Depiction of
3-(4-bromophenyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione
3-(4-bromophenyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione
Compound characteristics
| Compound ID: | C250-0271 |
| Compound Name: | 3-(4-bromophenyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione |
| Molecular Weight: | 337.28 |
| Molecular Formula: | C15 H17 Br N2 S |
| Smiles: | C1CCCC2(CC1)NC(C(c1ccc(cc1)[Br])=N2)=S |
| Stereo: | ACHIRAL |
| logP: | 4.5904 |
| logD: | 4.4383 |
| logSw: | -4.4142 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 21.0306 |
| InChI Key: | NPVIUEPTJSYJNC-UHFFFAOYSA-N |