6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
Chemical Structure Depiction of
6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
Compound characteristics
| Compound ID: | G290-1035 |
| Compound Name: | 6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C25 H23 F N4 O2 S |
| Smiles: | C(CN1C(c2cccnc2Sc2ccccc12)=O)C(N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7223 |
| logD: | 3.7223 |
| logSw: | -4.2072 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.783 |
| InChI Key: | RMBJLLTXTGIZSU-UHFFFAOYSA-N |