3-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5(6H)-yl)-N-(1-phenylethyl)propanamide
Chemical Structure Depiction of
3-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5(6H)-yl)-N-(1-phenylethyl)propanamide
3-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5(6H)-yl)-N-(1-phenylethyl)propanamide
Compound characteristics
| Compound ID: | E523-0416 |
| Compound Name: | 3-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5(6H)-yl)-N-(1-phenylethyl)propanamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C23 H21 N3 O2 S |
| Smiles: | CC(c1ccccc1)NC(CCN1C(c2ccccc2Sc2c1cccn2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5541 |
| logD: | 3.5541 |
| logSw: | -3.8055 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.066 |
| InChI Key: | DBOYJLZJNIZOMS-INIZCTEOSA-N |