(6S)-6-(propan-2-yl)-3-[4-(pyrimidin-2-yl)-1,4-diazepane-1-carbonyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one
Chemical Structure Depiction of
(6S)-6-(propan-2-yl)-3-[4-(pyrimidin-2-yl)-1,4-diazepane-1-carbonyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one
(6S)-6-(propan-2-yl)-3-[4-(pyrimidin-2-yl)-1,4-diazepane-1-carbonyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one
Compound characteristics
| Compound ID: | SD69-0606 |
| Compound Name: | (6S)-6-(propan-2-yl)-3-[4-(pyrimidin-2-yl)-1,4-diazepane-1-carbonyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one |
| Molecular Weight: | 384.44 |
| Molecular Formula: | C18 H24 N8 O2 |
| Smiles: | CC(C)[C@H]1Cn2c(C(N1)=O)c(C(N1CCCN(CC1)c1ncccn1)=O)nn2 |
| Stereo: | ABSOLUTE |
| logP: | 0.5988 |
| logD: | 0.5988 |
| logSw: | -1.5924 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.449 |
| InChI Key: | VHYPQCYCPAWPGS-CYBMUJFWSA-N |