7-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-10-(propan-2-yl)dibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
7-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-10-(propan-2-yl)dibenzo[b,f][1,4]thiazepin-11(10H)-one
7-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-10-(propan-2-yl)dibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0787 |
| Compound Name: | 7-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-10-(propan-2-yl)dibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C23 H19 N3 O2 S2 |
| Smiles: | CC(C)N1C(c2ccccc2Sc2cc(ccc12)c1nc(c2c(C)ccs2)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4809 |
| logD: | 6.4809 |
| logSw: | -5.6159 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.817 |
| InChI Key: | XKTQKPUMIQYBPE-UHFFFAOYSA-N |