N-(4-chlorophenyl)-2-{[3-(3-fluorophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-{[3-(3-fluorophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide
N-(4-chlorophenyl)-2-{[3-(3-fluorophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C250-0136 |
| Compound Name: | N-(4-chlorophenyl)-2-{[3-(3-fluorophenyl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 415.92 |
| Molecular Formula: | C21 H19 Cl F N3 O S |
| Smiles: | C1CCC2(C1)N=C(C(=N2)SCC(Nc1ccc(cc1)[Cl])=O)c1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 4.7009 |
| logD: | 4.7008 |
| logSw: | -4.9597 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.596 |
| InChI Key: | CTIYPXFQNKGKCB-UHFFFAOYSA-N |