6-ethyl-9-(pyrrolidine-1-carbonyl)pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
Chemical Structure Depiction of
6-ethyl-9-(pyrrolidine-1-carbonyl)pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
6-ethyl-9-(pyrrolidine-1-carbonyl)pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
Compound characteristics
| Compound ID: | P617-0486 |
| Compound Name: | 6-ethyl-9-(pyrrolidine-1-carbonyl)pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one |
| Molecular Weight: | 353.44 |
| Molecular Formula: | C19 H19 N3 O2 S |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)C(N1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6578 |
| logD: | 2.6578 |
| logSw: | -3.1897 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.464 |
| InChI Key: | DVJKSPINRCPEQU-UHFFFAOYSA-N |