6-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
Chemical Structure Depiction of
6-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
6-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one
Compound characteristics
| Compound ID: | G290-1010 |
| Compound Name: | 6-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}pyrido[2,3-b][1,5]benzothiazepin-5(6H)-one |
| Molecular Weight: | 472.61 |
| Molecular Formula: | C27 H28 N4 O2 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(CCN1C(c2cccnc2Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7018 |
| logD: | 4.7017 |
| logSw: | -4.3829 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.783 |
| InChI Key: | AICRVCPAQZTSSD-UHFFFAOYSA-N |