N-butyl-N-methyl-5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
N-butyl-N-methyl-5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
N-butyl-N-methyl-5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0579 |
| Compound Name: | N-butyl-N-methyl-5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 383.51 |
| Molecular Formula: | C21 H25 N3 O2 S |
| Smiles: | CCCCN(C)C(c1ccc2c(c1)Sc1c(cccn1)C(N2C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3335 |
| logD: | 3.3335 |
| logSw: | -3.6089 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.846 |
| InChI Key: | DLWSTGYDDGXOKO-UHFFFAOYSA-N |