methyl {[1-(2-amino-6-methylpyrimidin-4-yl)-1H-diazirin-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[1-(2-amino-6-methylpyrimidin-4-yl)-1H-diazirin-3-yl]sulfanyl}acetate
methyl {[1-(2-amino-6-methylpyrimidin-4-yl)-1H-diazirin-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 8015-3663 |
| Compound Name: | methyl {[1-(2-amino-6-methylpyrimidin-4-yl)-1H-diazirin-3-yl]sulfanyl}acetate |
| Molecular Weight: | 253.28 |
| Molecular Formula: | C9 H11 N5 O2 S |
| Smiles: | Cc1cc(nc(N)n1)N1C(=N1)SCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 0.9619 |
| logD: | 0.9552 |
| logSw: | -1.6608 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.345 |
| InChI Key: | WWGGMRQXRYWVQQ-UHFFFAOYSA-N |