N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2,4-dichlorophenyl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2,4-dichlorophenyl)quinoline-4-carboxamide
N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2,4-dichlorophenyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y500-5217 |
| Compound Name: | N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2,4-dichlorophenyl)quinoline-4-carboxamide |
| Molecular Weight: | 510.44 |
| Molecular Formula: | C26 H21 Cl2 N3 O2 S |
| Smiles: | C1CCc2c(C(N)=O)c(NC(c3cc(c4ccc(cc4[Cl])[Cl])nc4ccccc34)=O)sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.9655 |
| logD: | 5.7274 |
| logSw: | -6.2817 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.494 |
| InChI Key: | GDWOLJDBUHWVNK-UHFFFAOYSA-N |