2-{[3-(4-bromophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[3-(4-bromophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
2-{[3-(4-bromophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C250-0686 |
| Compound Name: | 2-{[3-(4-bromophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}-N-(5-chloro-2,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 536.87 |
| Molecular Formula: | C23 H23 Br Cl N3 O3 S |
| Smiles: | COc1cc(c(cc1NC(CSC1C(c2ccc(cc2)[Br])=NC2(CCCC2)N=1)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 4.9693 |
| logD: | 4.9626 |
| logSw: | -5.1795 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.159 |
| InChI Key: | CPSITXDQEYDQMX-UHFFFAOYSA-N |