10-cyclopropyl-7-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
10-cyclopropyl-7-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
10-cyclopropyl-7-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0457 |
| Compound Name: | 10-cyclopropyl-7-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 479.51 |
| Molecular Formula: | C27 H17 N3 O4 S |
| Smiles: | C1CC1N1C(c2ccccc2Sc2cc(ccc12)c1nc(C2=Cc3ccccc3OC2=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7442 |
| logD: | 5.7442 |
| logSw: | -5.9541 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.281 |
| InChI Key: | QETICTJOQKYAFF-UHFFFAOYSA-N |