2-{[2-(azepan-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{[2-(azepan-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
2-{[2-(azepan-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | C201-1511 |
| Compound Name: | 2-{[2-(azepan-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide |
| Molecular Weight: | 427.59 |
| Molecular Formula: | C21 H25 N5 O S2 |
| Smiles: | Cc1cccc(c1C)NC(CSc1c2c(ncn1)nc(N1CCCCCC1)s2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2494 |
| logD: | 5.2494 |
| logSw: | -4.8275 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.005 |
| InChI Key: | GHEHUTMXCNKPEE-UHFFFAOYSA-N |