N-(4-bromophenyl)-2-[(3-phenyl-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-[(3-phenyl-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl)sulfanyl]acetamide
N-(4-bromophenyl)-2-[(3-phenyl-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C250-0233 |
| Compound Name: | N-(4-bromophenyl)-2-[(3-phenyl-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 442.38 |
| Molecular Formula: | C21 H20 Br N3 O S |
| Smiles: | C1CCC2(C1)N=C(C(=N2)SCC(Nc1ccc(cc1)[Br])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5654 |
| logD: | 4.5653 |
| logSw: | -4.4199 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.596 |
| InChI Key: | HZBAWMBREPMTBW-UHFFFAOYSA-N |