6-methyl-N-[(5-methylfuran-2-yl)methyl]-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
6-methyl-N-[(5-methylfuran-2-yl)methyl]-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
6-methyl-N-[(5-methylfuran-2-yl)methyl]-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0279 |
| Compound Name: | 6-methyl-N-[(5-methylfuran-2-yl)methyl]-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 379.44 |
| Molecular Formula: | C20 H17 N3 O3 S |
| Smiles: | Cc1ccc(CNC(c2ccc3c(c2)Sc2c(cccn2)C(N3C)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.7953 |
| logD: | 2.7952 |
| logSw: | -3.4922 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.167 |
| InChI Key: | ZZJVBDYGZZDYFO-UHFFFAOYSA-N |