N-cyclopentyl-5-oxo-6-propyl-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-5-oxo-6-propyl-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
N-cyclopentyl-5-oxo-6-propyl-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0521 |
| Compound Name: | N-cyclopentyl-5-oxo-6-propyl-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 381.5 |
| Molecular Formula: | C21 H23 N3 O2 S |
| Smiles: | CCCN1C(c2cccnc2Sc2cc(ccc12)C(NC1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0209 |
| logD: | 4.0209 |
| logSw: | -4.0977 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.208 |
| InChI Key: | TXOYJBODPFQLDT-UHFFFAOYSA-N |