10-cyclopropyl-7-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
10-cyclopropyl-7-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
10-cyclopropyl-7-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0522 |
| Compound Name: | 10-cyclopropyl-7-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 501.56 |
| Molecular Formula: | C27 H23 N3 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)c1nc(c2ccc3c(c2)Sc2ccccc2C(N3C2CC2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.7102 |
| logD: | 5.7102 |
| logSw: | -5.4842 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.337 |
| InChI Key: | NBRKIINKEFTHDO-UHFFFAOYSA-N |