5-(1-ethyl-1H-pyrazole-4-sulfonyl)-2-(thiophen-2-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
Chemical Structure Depiction of
5-(1-ethyl-1H-pyrazole-4-sulfonyl)-2-(thiophen-2-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
5-(1-ethyl-1H-pyrazole-4-sulfonyl)-2-(thiophen-2-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
Compound characteristics
Compound ID: | P221-1452 |
Compound Name: | 5-(1-ethyl-1H-pyrazole-4-sulfonyl)-2-(thiophen-2-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine |
Molecular Weight: | 377.49 |
Molecular Formula: | C16 H19 N5 O2 S2 |
Smiles: | CCn1cc(cn1)S(N1CCCn2c(C1)cc(c1cccs1)n2)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.5681 |
logD: | 1.5681 |
logSw: | -2.2399 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 61 |
InChI Key: | OJJYJYQUMNBLPT-UHFFFAOYSA-N |