7-(4-chloro-2-methylbenzene-1-sulfonyl)-2-(cyclopropylmethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
7-(4-chloro-2-methylbenzene-1-sulfonyl)-2-(cyclopropylmethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
7-(4-chloro-2-methylbenzene-1-sulfonyl)-2-(cyclopropylmethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | CM4439-1880 |
| Compound Name: | 7-(4-chloro-2-methylbenzene-1-sulfonyl)-2-(cyclopropylmethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 382.87 |
| Molecular Formula: | C16 H19 Cl N4 O3 S |
| Smiles: | Cc1cc(ccc1S(N1CCN2C(C1)=NN(CC1CC1)C2=O)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.1278 |
| logD: | 3.1278 |
| logSw: | -3.3663 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.16 |
| InChI Key: | AJCKRYSTYOGIFK-UHFFFAOYSA-N |