9-[4-(3,5-dimethylbenzoyl)piperazine-1-sulfonyl]-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one
Chemical Structure Depiction of
9-[4-(3,5-dimethylbenzoyl)piperazine-1-sulfonyl]-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one
9-[4-(3,5-dimethylbenzoyl)piperazine-1-sulfonyl]-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one
Compound characteristics
| Compound ID: | G425-0027 |
| Compound Name: | 9-[4-(3,5-dimethylbenzoyl)piperazine-1-sulfonyl]-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one |
| Molecular Weight: | 467.59 |
| Molecular Formula: | C25 H29 N3 O4 S |
| Smiles: | Cc1cc(C)cc(c1)C(N1CCN(CC1)S(c1cc2CCCN3C(CCc(c1)c23)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0658 |
| logD: | 3.0658 |
| logSw: | -3.3559 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.643 |
| InChI Key: | QEVRMSXBFMZPDP-UHFFFAOYSA-N |