4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide
Chemical Structure Depiction of
4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide
4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide
Compound characteristics
| Compound ID: | G290-1176 |
| Compound Name: | 4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C22 H27 N3 O3 S |
| Smiles: | CC(C)OCCCNC(CCCN1C(c2cccnc2Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2168 |
| logD: | 2.2168 |
| logSw: | -2.8497 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.217 |
| InChI Key: | FAZVLBUAJVRVOZ-UHFFFAOYSA-N |