N-[11-oxo-10-(propan-2-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]pyridine-4-carboxamide
Chemical Structure Depiction of
N-[11-oxo-10-(propan-2-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]pyridine-4-carboxamide
N-[11-oxo-10-(propan-2-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | G943-0888 |
| Compound Name: | N-[11-oxo-10-(propan-2-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]pyridine-4-carboxamide |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C22 H19 N3 O2 S |
| Smiles: | CC(C)N1C(c2ccccc2Sc2cc(ccc12)NC(c1ccncc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9641 |
| logD: | 3.964 |
| logSw: | -4.1496 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.912 |
| InChI Key: | GBUFERGACDLOEU-UHFFFAOYSA-N |