4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-(2,4,6-trimethylphenyl)butanamide
Chemical Structure Depiction of
4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-(2,4,6-trimethylphenyl)butanamide
4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-(2,4,6-trimethylphenyl)butanamide
Compound characteristics
| Compound ID: | G290-1141 |
| Compound Name: | 4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-(2,4,6-trimethylphenyl)butanamide |
| Molecular Weight: | 431.56 |
| Molecular Formula: | C25 H25 N3 O2 S |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(CCCN1C(c2cccnc2Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0223 |
| logD: | 4.0223 |
| logSw: | -4.0893 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.185 |
| InChI Key: | MPILBDLEBDPBDV-UHFFFAOYSA-N |