N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-5-methylthiophene-2-carboxamide
Chemical Structure Depiction of
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-5-methylthiophene-2-carboxamide
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-5-methylthiophene-2-carboxamide
Compound characteristics
| Compound ID: | P895-0188 |
| Compound Name: | N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-5-methylthiophene-2-carboxamide |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C20 H17 N3 O2 S2 |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)NC(c1ccc(C)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.591 |
| logD: | 4.5909 |
| logSw: | -4.3429 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.559 |
| InChI Key: | HNZKCWJNTXFZOJ-UHFFFAOYSA-N |