2-{[2-(azepan-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{[2-(azepan-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide
2-{[2-(azepan-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | C201-1631 |
| Compound Name: | 2-{[2-(azepan-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 515.7 |
| Molecular Formula: | C25 H33 N5 O3 S2 |
| Smiles: | CCOc1ccc(CCNC(CSc2c3c(ncn2)nc(N2CCCCCC2)s3)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.0832 |
| logD: | 4.0832 |
| logSw: | -4.0209 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.287 |
| InChI Key: | MADQIMUEMGIKJW-UHFFFAOYSA-N |