N-butyl-6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-butyl-6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
N-butyl-6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | K692-0077 |
| Compound Name: | N-butyl-6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C23 H25 N3 O4 S |
| Smiles: | CCCCNC(C1=CNc2ccc(cc2C1=O)S(N1CCc2ccccc2C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4299 |
| logD: | 1.9394 |
| logSw: | -3.8106 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.257 |
| InChI Key: | MVZOHTYNSFXJDR-UHFFFAOYSA-N |