N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-(4-nitrophenyl)acetamide
Chemical Structure Depiction of
N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-(4-nitrophenyl)acetamide
N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-(4-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | G943-0514 |
| Compound Name: | N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-(4-nitrophenyl)acetamide |
| Molecular Weight: | 445.5 |
| Molecular Formula: | C24 H19 N3 O4 S |
| Smiles: | C1CC1N1C(c2ccccc2Sc2cc(ccc12)NC(Cc1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8072 |
| logD: | 4.8072 |
| logSw: | -4.8689 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.213 |
| InChI Key: | BIIZGFGQMUQPRI-UHFFFAOYSA-N |