2-{[3-(4-bromophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}-N-(3-chloro-4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[3-(4-bromophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}-N-(3-chloro-4-methoxyphenyl)acetamide
2-{[3-(4-bromophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}-N-(3-chloro-4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C250-0605 |
| Compound Name: | 2-{[3-(4-bromophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}-N-(3-chloro-4-methoxyphenyl)acetamide |
| Molecular Weight: | 506.85 |
| Molecular Formula: | C22 H21 Br Cl N3 O2 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CSC1C(c2ccc(cc2)[Br])=NC2(CCCC2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1811 |
| logD: | 5.1808 |
| logSw: | -5.7124 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.227 |
| InChI Key: | VUCKZULBHHPTMB-UHFFFAOYSA-N |