N-(2,6-dimethylphenyl)-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide
N-(2,6-dimethylphenyl)-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G698-0314 |
| Compound Name: | N-(2,6-dimethylphenyl)-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 397.56 |
| Molecular Formula: | C21 H23 N3 O S2 |
| Smiles: | Cc1cccc(C)c1NC(CSC1C(c2cccs2)=NC2(CCCC2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9481 |
| logD: | 3.9481 |
| logSw: | -3.8477 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.219 |
| InChI Key: | SBJCTQZGAFHRID-UHFFFAOYSA-N |