5-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
Chemical Structure Depiction of
5-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
5-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
Compound characteristics
| Compound ID: | C498-0672 |
| Compound Name: | 5-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide |
| Molecular Weight: | 459.61 |
| Molecular Formula: | C27 H29 N3 O2 S |
| Smiles: | Cc1cccc(CN2CCC(CC2)CNC(c2cc3C(N(C)c4ccccc4c3s2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6488 |
| logD: | 2.1564 |
| logSw: | -4.4637 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.271 |
| InChI Key: | DVFMMOUXIKVRBK-UHFFFAOYSA-N |