N-[(furan-2-yl)methyl]-N-[3-(morpholin-4-yl)propyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N-[3-(morpholin-4-yl)propyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-[(furan-2-yl)methyl]-N-[3-(morpholin-4-yl)propyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-2718 |
| Compound Name: | N-[(furan-2-yl)methyl]-N-[3-(morpholin-4-yl)propyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 465.59 |
| Molecular Formula: | C21 H27 N3 O5 S2 |
| Smiles: | C(CN1CCOCC1)CN(Cc1ccco1)S(c1ccc2c(c1)NC(CCS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8569 |
| logD: | 1.7859 |
| logSw: | -2.7199 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.112 |
| InChI Key: | VBIUVKCIBJVSPK-UHFFFAOYSA-N |