4-methyl-N-{[3-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-1,2,4-oxadiazol-5-yl]methyl}benzamide
Chemical Structure Depiction of
4-methyl-N-{[3-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-1,2,4-oxadiazol-5-yl]methyl}benzamide
4-methyl-N-{[3-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-1,2,4-oxadiazol-5-yl]methyl}benzamide
Compound characteristics
| Compound ID: | G946-0029 |
| Compound Name: | 4-methyl-N-{[3-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-1,2,4-oxadiazol-5-yl]methyl}benzamide |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C25 H20 N4 O3 S |
| Smiles: | Cc1ccc(cc1)C(NCc1nc(c2ccc3c(c2)Sc2ccccc2C(N3C)=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8256 |
| logD: | 4.8256 |
| logSw: | -4.5295 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.194 |
| InChI Key: | UKKTUQZXPCIPNR-UHFFFAOYSA-N |