2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-phenylacetamide
2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | C916-0004 |
| Compound Name: | 2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C23 H26 N4 O2 S |
| Smiles: | CN1CCC2(CC1)N=C(C(=N2)SCC(Nc1ccccc1)=O)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.602 |
| logD: | 0.1132 |
| logSw: | -3.1564 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.251 |
| InChI Key: | MQMFRTDJSLCRLM-UHFFFAOYSA-N |