N-[2-(1H-imidazol-4-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-[2-(1H-imidazol-4-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
N-[2-(1H-imidazol-4-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | C798-1076 |
| Compound Name: | N-[2-(1H-imidazol-4-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide |
| Molecular Weight: | 379.44 |
| Molecular Formula: | C19 H17 N5 O2 S |
| Smiles: | C(CNC(CN1C(c2cccnc2Sc2ccccc12)=O)=O)c1c[nH]cn1 |
| Stereo: | ACHIRAL |
| logP: | 1.3488 |
| logD: | 1.251 |
| logSw: | -2.4386 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.56 |
| InChI Key: | GOUIECYPZUZTHL-UHFFFAOYSA-N |