10-ethyl-7-[5-(1-methyl-1H-pyrazol-5-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
10-ethyl-7-[5-(1-methyl-1H-pyrazol-5-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
10-ethyl-7-[5-(1-methyl-1H-pyrazol-5-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0296 |
| Compound Name: | 10-ethyl-7-[5-(1-methyl-1H-pyrazol-5-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C21 H17 N5 O2 S |
| Smiles: | CCN1C(c2ccccc2Sc2cc(ccc12)c1nc(c2ccnn2C)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2784 |
| logD: | 4.2784 |
| logSw: | -4.3502 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.453 |
| InChI Key: | HGIUQURXJLNYPP-UHFFFAOYSA-N |