N-[2-(5-methyl-1H-indol-2-yl)ethyl]-3-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)propanamide
Chemical Structure Depiction of
N-[2-(5-methyl-1H-indol-2-yl)ethyl]-3-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)propanamide
N-[2-(5-methyl-1H-indol-2-yl)ethyl]-3-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)propanamide
Compound characteristics
| Compound ID: | C798-1008 |
| Compound Name: | N-[2-(5-methyl-1H-indol-2-yl)ethyl]-3-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)propanamide |
| Molecular Weight: | 456.57 |
| Molecular Formula: | C26 H24 N4 O2 S |
| Smiles: | Cc1ccc2c(c1)cc(CCNC(CCN1C(c3cccnc3Sc3ccccc13)=O)=O)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 3.8264 |
| logD: | 3.8264 |
| logSw: | -3.7428 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.589 |
| InChI Key: | OWNAMVUXDSJNMI-UHFFFAOYSA-N |