N-(2-bromophenyl)-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-(2-bromophenyl)-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
N-(2-bromophenyl)-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | G290-0026 |
| Compound Name: | N-(2-bromophenyl)-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)acetamide |
| Molecular Weight: | 440.32 |
| Molecular Formula: | C20 H14 Br N3 O2 S |
| Smiles: | C(C(Nc1ccccc1[Br])=O)N1C(c2cccnc2Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9484 |
| logD: | 3.9484 |
| logSw: | -4.2316 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.905 |
| InChI Key: | DULGKAQKVPNCCB-UHFFFAOYSA-N |