2-(cyclopropylmethyl)-7-(2,4,5-trimethylbenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
2-(cyclopropylmethyl)-7-(2,4,5-trimethylbenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
2-(cyclopropylmethyl)-7-(2,4,5-trimethylbenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | CM4439-2295 |
| Compound Name: | 2-(cyclopropylmethyl)-7-(2,4,5-trimethylbenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 376.48 |
| Molecular Formula: | C18 H24 N4 O3 S |
| Smiles: | Cc1cc(C)c(cc1C)S(N1CCN2C(C1)=NN(CC1CC1)C2=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2392 |
| logD: | 3.2392 |
| logSw: | -3.3091 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.16 |
| InChI Key: | VWLLYYLWHSWCPR-UHFFFAOYSA-N |