[3-(4-bromophenyl)-2-sulfanylidene-1,4-diazaspiro[4.4]non-3-en-1-yl](3,4,5-trimethoxyphenyl)methanone
Chemical Structure Depiction of
[3-(4-bromophenyl)-2-sulfanylidene-1,4-diazaspiro[4.4]non-3-en-1-yl](3,4,5-trimethoxyphenyl)methanone
[3-(4-bromophenyl)-2-sulfanylidene-1,4-diazaspiro[4.4]non-3-en-1-yl](3,4,5-trimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | C250-0621 |
| Compound Name: | [3-(4-bromophenyl)-2-sulfanylidene-1,4-diazaspiro[4.4]non-3-en-1-yl](3,4,5-trimethoxyphenyl)methanone |
| Molecular Weight: | 503.41 |
| Molecular Formula: | C23 H23 Br N2 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1C(C(c2ccc(cc2)[Br])=NC12CCCC2)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3573 |
| logD: | 4.3573 |
| logSw: | -4.4189 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 47.149 |
| InChI Key: | UMPHHWOPPYGJJB-UHFFFAOYSA-N |