N-[2-(1H-indol-3-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
N-[2-(1H-indol-3-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | G290-0104 |
| Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C24 H20 N4 O2 S |
| Smiles: | C(CNC(CN1C(c2cccnc2Sc2ccccc12)=O)=O)c1c[nH]c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.3893 |
| logD: | 3.3893 |
| logSw: | -3.7306 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.637 |
| InChI Key: | MUCCAWWPKAVLEY-UHFFFAOYSA-N |