5-bromo-N-[11-oxo-10-(propan-2-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]pyridine-3-carboxamide
Chemical Structure Depiction of
5-bromo-N-[11-oxo-10-(propan-2-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]pyridine-3-carboxamide
5-bromo-N-[11-oxo-10-(propan-2-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | G943-0860 |
| Compound Name: | 5-bromo-N-[11-oxo-10-(propan-2-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]pyridine-3-carboxamide |
| Molecular Weight: | 468.37 |
| Molecular Formula: | C22 H18 Br N3 O2 S |
| Smiles: | CC(C)N1C(c2ccccc2Sc2cc(ccc12)NC(c1cc(cnc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1284 |
| logD: | 5.1281 |
| logSw: | -4.8857 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.091 |
| InChI Key: | VHJNFAMJQPUVBD-UHFFFAOYSA-N |