N-(3-ethoxypropyl)-2-(4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Chemical Structure Depiction of
N-(3-ethoxypropyl)-2-(4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
N-(3-ethoxypropyl)-2-(4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Compound characteristics
| Compound ID: | C756-0119 |
| Compound Name: | N-(3-ethoxypropyl)-2-(4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide |
| Molecular Weight: | 322.42 |
| Molecular Formula: | C16 H22 N2 O3 S |
| Smiles: | CCOCCCNC(CN1C(CCSc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6554 |
| logD: | 1.6554 |
| logSw: | -2.3324 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.512 |
| InChI Key: | VDOOBLYGWAEDRP-UHFFFAOYSA-N |