(4-bromophenyl)[3-(3,5-dimethoxyphenyl)-2-sulfanylidene-1,4-diazaspiro[4.5]dec-3-en-1-yl]methanone
Chemical Structure Depiction of
(4-bromophenyl)[3-(3,5-dimethoxyphenyl)-2-sulfanylidene-1,4-diazaspiro[4.5]dec-3-en-1-yl]methanone
(4-bromophenyl)[3-(3,5-dimethoxyphenyl)-2-sulfanylidene-1,4-diazaspiro[4.5]dec-3-en-1-yl]methanone
Compound characteristics
| Compound ID: | C250-0641 |
| Compound Name: | (4-bromophenyl)[3-(3,5-dimethoxyphenyl)-2-sulfanylidene-1,4-diazaspiro[4.5]dec-3-en-1-yl]methanone |
| Molecular Weight: | 487.41 |
| Molecular Formula: | C23 H23 Br N2 O3 S |
| Smiles: | COc1cc(cc(c1)OC)C1C(N(C(c2ccc(cc2)[Br])=O)C2(CCCCC2)N=1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.3644 |
| logD: | 5.3644 |
| logSw: | -5.1844 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 38.893 |
| InChI Key: | KPVOOFUFVUGOBN-UHFFFAOYSA-N |