N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | G290-0217 |
| Compound Name: | N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C24 H21 N3 O4 S |
| Smiles: | CC(c1ccc2c(c1)OCCO2)NC(CN1C(c2cccnc2Sc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7651 |
| logD: | 2.7651 |
| logSw: | -3.4847 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.911 |
| InChI Key: | DKMFMNGQKXMSFU-HNNXBMFYSA-N |