4-cyano-N-(11-oxo-10-propyl-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)benzamide
Chemical Structure Depiction of
4-cyano-N-(11-oxo-10-propyl-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)benzamide
4-cyano-N-(11-oxo-10-propyl-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)benzamide
Compound characteristics
| Compound ID: | G943-0344 |
| Compound Name: | 4-cyano-N-(11-oxo-10-propyl-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)benzamide |
| Molecular Weight: | 413.5 |
| Molecular Formula: | C24 H19 N3 O2 S |
| Smiles: | CCCN1C(c2ccccc2Sc2cc(ccc12)NC(c1ccc(C#N)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1512 |
| logD: | 5.1512 |
| logSw: | -4.8514 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.798 |
| InChI Key: | YPMLXAVQYHCNMB-UHFFFAOYSA-N |