5-bromo-N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)furan-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)furan-2-carboxamide
5-bromo-N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)furan-2-carboxamide
Compound characteristics
| Compound ID: | P895-0010 |
| Compound Name: | 5-bromo-N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)furan-2-carboxamide |
| Molecular Weight: | 430.28 |
| Molecular Formula: | C18 H12 Br N3 O3 S |
| Smiles: | CN1C(c2cccnc2Sc2cc(ccc12)NC(c1ccc(o1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2584 |
| logD: | 3.2579 |
| logSw: | -3.7951 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.507 |
| InChI Key: | IDDUKVUAKWHAGE-UHFFFAOYSA-N |