N-[3-(methylsulfanyl)phenyl]-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide
N-[3-(methylsulfanyl)phenyl]-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G698-0354 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 415.6 |
| Molecular Formula: | C20 H21 N3 O S3 |
| Smiles: | CSc1cccc(c1)NC(CSC1C(c2cccs2)=NC2(CCCC2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2243 |
| logD: | 4.2243 |
| logSw: | -4.2489 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.615 |
| InChI Key: | CSIUDVAMNJHELW-UHFFFAOYSA-N |