6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
Chemical Structure Depiction of
6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
Compound characteristics
| Compound ID: | G290-1004 |
| Compound Name: | 6-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one |
| Molecular Weight: | 381.5 |
| Molecular Formula: | C21 H23 N3 O2 S |
| Smiles: | CC1CCN(CC1)C(CCN1C(c2cccnc2Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2389 |
| logD: | 3.2389 |
| logSw: | -3.7086 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.824 |
| InChI Key: | FOXRKLVPMWGUIM-UHFFFAOYSA-N |